Your browser doesn't support javascript.
loading
Show: 20 | 50 | 100
Results 1 - 20 de 29
Filter
1.
Luminescence ; 39(5): e4750, 2024 May.
Article in English | MEDLINE | ID: mdl-38733198

ABSTRACT

Ultra-high thermally stable Ca2MgWO6:xSm3+ (x = 0.5, 0.75, 1, 1.25, and 1.5 mol%) double perovskite phosphors were synthesized through solid-state reaction method. Product formation was confirmed by comparing the X-ray diffraction (XRD) patterns of the phosphors with the standard reference file. The structural, morphological, thermal, and optical properties of the prepared phosphor were examined in detail using XRD, Fourier transform infrared spectra, scanning electron microscopy, diffused reflectance spectra, thermogravimetric analysis (TGA), photoluminescence emission, and temperature-dependent PLE (TDPL). It was seen that the phosphor exhibited emission in the reddish region for the near-ultraviolet excitation with moderate Colour Rendering Index values and high colour purity. The optimized phosphor (x = 1.25 mol%) was found to possess a direct optical band gap of 3.31 eV. TGA studies showed the astonishing thermal stability of the optimized phosphor. Additionally, near-zero thermal quenching was seen in TDPL due to elevated phonon-assisted radiative transition. Furthermore, the anti-Stokes and Stokes emission peaks were found to be sensitive toward the temperature change and followed a Boltzmann-type distribution. All these marked properties will make the prepared phosphors a suitable candidate for multifield applications and a fascinating material for further development.


Subject(s)
Luminescence , Luminescent Agents , Samarium , Temperature , Tungsten Compounds , Tungsten Compounds/chemistry , Luminescent Agents/chemistry , Luminescent Agents/chemical synthesis , Samarium/chemistry , Luminescent Measurements , X-Ray Diffraction , Calcium Compounds/chemistry , Oxides/chemistry , Thermogravimetry
2.
Radiat Prot Dosimetry ; 199(20): 2464-2468, 2023 Dec 21.
Article in English | MEDLINE | ID: mdl-38126868

ABSTRACT

In this work, copper (Cu)-doped titanium dioxide (TiO2) nanoparticles were prepared by co-precipitation. For studying the morphological properties, the copper doped titanium dioxide (TiO2:Cu) nanocrystalline structures were characterised through powder X-ray diffraction and field emission scanning electron microscopy. The prepared TiO2:Cu nanoparticles were annealed at two temperatures, namely, copper doped titanium dioxide annealed at 723 K temperayure (TC1) and copper doped titanium dioxide annealed at 1073 K temperayure (TC2). The annealed samples were exposed to gamma radiation of 10-Gy-to-25-kGy doses. Thermoluminescence and dosimetric properties were evaluated using a thermoluminescent dosemeter reader. The glow curves of the TiO2:Cu nanoparticles were analysed. The thermoluminescence (TL) response of samples exhibited good linearity between 100 Gy and 10 kGy with high sensitivity of 1755.25 (TC1) and 5587.06 (TC2) counts g-1Gy-1 and a minimum detectable dose of 2.9666 Gy (TC1) and 0.4892 Gy (TC2). The fading of signals was observed by 12% for TC1 and 10% for TC2 samples after a week of storage.


Subject(s)
Copper , Nanoparticles , Gamma Rays , Microscopy, Electron, Scanning
3.
Indian J Med Res ; 155(1): 165-170, 2022 01.
Article in English | MEDLINE | ID: mdl-35417991

ABSTRACT

Background & objectives: COVID-19 cases have been rising rapidly in countries where the SARS-CoV-2 variant of concern (VOC), Omicron (B.1.1.529) has been reported. We conducted a study to describe the epidemiological and clinical characteristics and outcomes of COVID-19 patients with 'S' gene target failure (SGTF, suspected Omicron). Furthermore, their clinical outcomes with COVID-19 patients with non-SGTF (non-Omicron) were also compared. Methods: This study was conducted in Tamil Nadu, India, between December 14, 2021 and January 7, 2022 among patients who underwent reverse transcription-PCR testing for SARS-CoV-2 in four laboratories with facilities for S gene screening. Consecutively selected COVID-19 patients with SGTF were telephonically contacted, seven and 14 days respectively after their date of positive result to collect information on the socio-demographic characteristics, previous history of COVID-19, vaccination status and clinical course of illness along with treatment details. To compare their outcomes with non-SGTF patients, one randomly suspected non-Omicron case for every two suspected Omicron cases from the line-list were selected, matching for the date of sample collection and the testing laboratory. Results: A total of 1175 SGTF COVID-19 patients were enrolled for this study. Almost 6 per cent (n=72) reported a history of previous infection. 141 (13.5%) suspected Omicron cases were non-vaccinated, while 148 (14.2%) and 703 (67.4%) had received valid one and two doses of COVID-19 vaccines, respectively. Predominant symptoms reported included fever (n=508, 43.2%), body pain (n=275, 23.4%), running nose (n=261, 22.2%) and cough (n=249, 21.2%). Five (0.4%) of the 1175 suspected Omicron cases required oxygen supplementation as compared to ten (1.6%) of the 634 suspected non-Omicron cases. No deaths were reported among omicron suspects, whereas there were four deaths among suspected non-Omicron cases. Interpretation & conclusions: Majority of the suspected Omicron cases had a mild course of illness. The overall severity of these cases was less compared to the suspected non-Omicron cases.


Subject(s)
COVID-19 , SARS-CoV-2 , COVID-19/epidemiology , COVID-19 Vaccines , Humans , India/epidemiology , SARS-CoV-2/genetics
4.
Luminescence ; 37(5): 828-836, 2022 May.
Article in English | MEDLINE | ID: mdl-35293139

ABSTRACT

Motivated by our previous study on Sm3+ ions as thermoluminescence (TL) sensitizers to the BaO-ZnO-LiF-B2 O3 -Yb2 O3 glass system, in the current study we examined the effect of Er3+ ion co-doping on the TL characteristics of this glass system. The 4f-4f electronic transitions of the Er3+ and Yb3+ ions were confirmed via the optical absorption spectrum. Notably, the use of Yb3+ -Er3+ ions failed to improve the TL intensity, sensitivity, and trap density. However, they enabled the glass system to function as an activator-quencher system. The linearity range and effective atomic number remained unaffected after co-doping. In addition, the problem of anomalous fading caused a remnant signal of just 58% after a week of storage of the Yb3+ monodoped glass. This was resolved by the optimum co-doping of Er3+ ions to achieve an 89% signal. The co-doping of Er3+ ions to the BaO-ZnO-LiF-B2 O3 -Yb2 O3 glass system regulated its thermal stability and therefore supplemented its potential for radiation monitoring in food processing and retrospective dosimetry.


Subject(s)
Zinc Oxide , Glass , Ions , Retrospective Studies , Thermoluminescent Dosimetry
5.
Materials (Basel) ; 15(4)2022 Feb 11.
Article in English | MEDLINE | ID: mdl-35207868

ABSTRACT

We analyzed the mechanical properties and radiation-shielding performance of a lithium zinc bismuth silicate glass system. The composition of these glasses is 20ZnO-30Li2O-(50-x)SiO2-xBi2O3 (x varies between 10 and 40 mol%). The mechanical properties of the investigated glass system, such as Young's modulus (E), bulk modulus (K), shear modulus (S), and longitudinal modulus (L), were determined using the Makishima-Mackenzie model. The elastic moduli gradually decreased with the addition of Bi2O3. E decreased from 46 to 31 GPa, K decreased from 27 to 14 GPa, S decreased from 19 to 14 GPa, and L decreased from 52 to 32 GPa as Bi2O3 was substituted for SiO2. The mass attenuation coefficient (MAC) was investigated at energies between 0.284 and 1.33 MeV to understand the radiation-shielding performance of the glasses. The MAC value increased when SiO2 was replaced by Bi2O3. We found that the effect of Bi2O3 on MAC values was noticeably stronger at energies of 0.284 and 0.347 MeV, while the effect of Bi2O3 on MAC values became weaker as energy increased. The linear attenuation coefficient (LAC) results demonstrated that if the samples were exposed to low-energy photons, the glass could prevent the penetration of photons, and thus, the glass samples were effective in radiation protection. The LAC values for the lowest- and highest-density samples changed from 0.998 to 1.976 cm-1 (at 0.284 MeV) and from 0.286 to 0.424 cm-1 (at 0.826 MeV). According to the radiation-shielding results, the thick, high-density glass sample has special and distinctive shielding properties.

6.
Materials (Basel) ; 14(22)2021 Nov 17.
Article in English | MEDLINE | ID: mdl-34832355

ABSTRACT

A Yb3+-doped borate glass system was examined for the structural and optical modifications after γ-irradiation. Among the studied 10BaO-20ZnO-20LiF-(50-x)B2O3-xYb2O3 (x = 0.1, 0.5, 0.7, and 1.0 mol%) glasses, the 10BaO-20ZnO-20LiF-49.9B2O3-0.1Yb2O3 glass showed the highest thermoluminescence intensity, trap density, and trap depth. The glass was irradiated with the optimum γ-dose of 1 kGy towards the analysis of radiation-induced defects. The amorphous nature was preserved before and after irradiation. The glass density slightly increased after irradiation. The structural rearrangement was evident from the Fourier transform infrared spectroscopy by the appearance and disappearance of some bonds after γ-irradiation. The transformation of [BO4] units into [BO3] units and non-bridging oxygens was deduced. The color of the glass darkened after irradiation and the optical absorption intensity enhanced between 250 and 700 nm. The optical bandgap reduced and Urbach energy increased upon γ-dose exposure. The electron spin resonance of the irradiated glass exhibited two signals at g = 2.0167 and g = 1.9938, corresponding to the non-bridging oxygen hole center and Boron E'-center, respectively.

7.
EClinicalMedicine ; 33: 100762, 2021 Mar.
Article in English | MEDLINE | ID: mdl-33842864

ABSTRACT

BACKGROUND: Premature babies suffer higher mortality and life-long disabilities. Asymptomatic bacteriuria (ASB) is postulated to induce preterm labor. Routine antenatal screening for ASB using urine culture is not feasible in most developing countries due to long turn-around time, user-unfriendliness, and lack of resources. The current parallel-group superiority pragmatic randomized controlled trial evaluated the effect of screening and evidence-based treatment of ASB using an optical-sensor-based point-of-care rapid-test on the incidence of preterm birth and low birthweight (LBW). METHODS: 240 consenting asymptomatic pregnant women visiting an Indian tertiary public hospital for first antenatal check-up, irrespective of trimester/gravida, who had not consumed antibiotics in the preceding week, were enrolled from February-May 2017. Computer-generated concealed simple randomization allocation sequence was used to assign participants to intervention (120) and control arm (120). Usual hospital-care was provided in the control arm. In the intervention arm, urine samples were additionally screened for ASB using the rapid-test and the positive women were prescribed susceptible antibiotics. Blinded outcome assessors followed up with women post-delivery. The study was registered with the Clinical Trials Registry-India (CTRI/2016/09/007240). FINDINGS: 213 participants were analyzed (intervention: 103, control: 110). 21 women were found positive for ASB and prescribed pathogen-specific antibiotics. The incidence of preterm birth/LBW in intervention arm (n = 27) was lower than control arm (n = 45) by 14·7% (95% CI: 2·2-27·2); RR: 0.64, (95% CI: 0·43-0·95); p = 0·023, X2=5·13. INTERPRETATION: Rapid-test-guided treatment for ASB reduced the incidence of preterm birth/LBW in a pragmatic setting without any adverse event. FUNDING: Department of Biotechnology, Government of India.

8.
Indian J Community Med ; 44(3): 193-198, 2019.
Article in English | MEDLINE | ID: mdl-31602101

ABSTRACT

Recommended urine culture is unsuitable for screening pregnant women for asymptomatic bacteriuria due to long turn-around time, unaffordability, and user-unfriendliness. The objective of this review was to evaluate the suitability of various tests for this purpose. A PubMed-based systematic review of published articles irrespective of year and language was done. Search terms included asymptomatic bacteriuria, screening test, urinary tract infection, and diagnostic test. Diagnostic accuracy studies conducted on human populations comparing tests with urine culture were included. One author extracted predefined data fields, including quality indicators, another validated it. Of 78 records, 25 studies describing 15 tests were included. All tests were rapid, seven were valid and two of them were affordable and easy-to-use. No test provided comprehensive identification with antibiotic susceptibility. Despite publication bias, no test was found suitable for screening asymptomatic bacteriuria antenatally and providing evidence-based prescription. Further research is needed to develop tests which suit this purpose.

9.
Asia Pac J Ophthalmol (Phila) ; 5(4): 282-92, 2016.
Article in English | MEDLINE | ID: mdl-27488070

ABSTRACT

Gene mapping of inherited ophthalmic diseases such as congenital cataracts, retinal degeneration, glaucoma, age-related macular degeneration, myopia, optic atrophy, and eye malformations has shed more light on the disease pathology, identified targets for research on therapeutics, earlier detection, and treatment options for disease management and patient care. This article details the different approaches to gene identification for both Mendelian and complex eye disorders.


Subject(s)
Chromosome Mapping/methods , Eye Diseases, Hereditary/genetics , Animals , Animals, Genetically Modified , Disease Models, Animal , Genetic Linkage , Humans , Polymorphism, Single Nucleotide/genetics , Sequence Analysis, DNA/methods
10.
Spectrochim Acta A Mol Biomol Spectrosc ; 151: 696-706, 2015 Dec 05.
Article in English | MEDLINE | ID: mdl-26163794

ABSTRACT

Boric oxide based quaternary glasses in the system PbF2-TeO2-B2O3-Eu2O3 have been prepared by melt quenching technique. Density, molar volume, FTIR, UV-Vis techniques were used to probe the structural modifications with incorporation of europium ions in the glass network. An increase in glass density & decrease in molar volume (Vm) values proved the structural changes occurring in coordination of boron atom [conversion of BO3 units to BO4]. This resulted in the increase of the compaction of the prepared glasses with increase in Eu2O3 contents. The amorphous natures of the samples were ascertained by XRD and metallization criterion (M) studies. XPS study showed the values of core-level binding energy [O1s, Eu3d, Eu4d, Te3d, Te4d, Pd4f, Pb5d, O1s, and F1s] of (PbF2-TeO2-B2O3-Eu2O3) the glass matrix. The frequency and temperature dependence of dielectric properties of present glasses were investigated in the frequency range of 1 Hz-10 MHz and temperature range of 313-773K. The study of dielectric measurements proved good insulating and thermal stability of the prepared glasses. At room temperature, dielectric loss [tanδ] values were negligibly small for prepared glasses and increased with increase in temperature. FTIR spectroscopy results were in good agreement with optical band energy gap, density, molar volume and hardness values revealing network modifications caused by europium ions in the glass structure.

11.
Colloids Surf B Biointerfaces ; 108: 60-5, 2013 Aug 01.
Article in English | MEDLINE | ID: mdl-23528605

ABSTRACT

The activity of a nano sized particle is said to be greater when compared to that of its parent materials combined. Thus, an attempt was made to produce gold nanostructures having unusual physicochemical properties. In this study, eco-friendly, non-toxic gold nanoparticles (Au NPs) were biologically synthesized using the leaf extract of Euphorbia hirta L. The synthesis of Au NPs was confirmed by a change in extract color from pale yellow to purple and surface plasmon resonance spectra obtained in a range of approximately 530nm. Nanoparticles whose sizes ranged from 6nm to 71nm, were synthesized. Different instrumental techniques were used to characterize the synthesized AuNPs, such TEM, XRD, EDAX, AFM, particle size analyzer, FTIR and Raman spectra. Also the antibacterial activity of the green synthesized Au NPs against bacterial strains of Escherchia coli, Pseudomonas aeroginosa and Klebsiella pneumonia was studied using MIC method, and found to be highly effective.


Subject(s)
Anti-Bacterial Agents/chemistry , Euphorbia/chemistry , Gold/chemistry , Metal Nanoparticles/chemistry , Plant Extracts/chemistry , Plant Leaves/chemistry , Anti-Bacterial Agents/pharmacology , Escherichia coli/drug effects , Escherichia coli/growth & development , Green Chemistry Technology , Klebsiella pneumoniae/drug effects , Klebsiella pneumoniae/growth & development , Metal Nanoparticles/ultrastructure , Microbial Sensitivity Tests , Microscopy, Electron, Scanning , Particle Size , Pseudomonas aeruginosa/drug effects , Pseudomonas aeruginosa/growth & development , Spectroscopy, Fourier Transform Infrared , Surface Plasmon Resonance
12.
J Biomed Opt ; 16(6): 067001, 2011 Jun.
Article in English | MEDLINE | ID: mdl-21721822

ABSTRACT

Photoacoustic spectra of normal, benign, and malignant ovarian tissues are recorded using 325-nm pulsed laser excitation in vitro. A total of 102 (34 normal, 38 benign, and 30 malignant) spectra are obtained from 22 samples belonging to normal, benign, and malignant subjects. Applying multi-algorithm approach, comprised of methods such as, principal component analysis (PCA) based k-nearest neighbor (k-NN) analysis, artificial neural network (ANN) analysis, and support vector machine (SVM) analysis, classification of the data has been carried out. For PCA, first the calibration set is formed by pooling 45 spectra, 15 belonging to each of pathologically certified normal, benign, and malignant samples. PCA is then performed on the data matrix, comprised of the six spectral features extracted from each of 45 calibration samples, and three principal components (PCs) containing maximum diagnostic information are selected. The scores of the selected PCs are used to train the k-NN, ANN, and SVM classifiers. The ANN used is a classical multilayer feed forward network with back propagation algorithm for its training. For k-NN, the Euclidean distance based algorithm is used and for SVM, one-versus-rest multiclass kernel-radial basis function is used. The performance evaluation of the classification results are obtained by calculating statistical parameters like specificity and sensitivity. ANN and k-NN techniques showed identical performance with specificity and sensitivity values of 100 and 86.76%, whereas SVM had these values at 100 and 80.18%, respectively. In order to determine the relative diagnostic performance of the techniques, receiver operating characteristics analysis is also performed.


Subject(s)
Elasticity Imaging Techniques/methods , Ovarian Neoplasms/chemistry , Ovary/chemistry , Signal Processing, Computer-Assisted , Algorithms , Artificial Intelligence , Female , Humans , Pilot Projects , Principal Component Analysis , ROC Curve
13.
Photomed Laser Surg ; 29(4): 227-32, 2011 Apr.
Article in English | MEDLINE | ID: mdl-21166576

ABSTRACT

OBJECTIVE: The objective of this study was to evaluate the efficacy of laser-induced fluorescence (LIF) in combination with principal component analysis (PCA) to characterize osteoporotic conditions induced by ovariectomy (OVX) in mice. BACKGROUND DATA: The dual energy X-ray absorptiometry is the gold standard methodology routinely used to diagnose osteoporosis. In recent years, the use of LIF to characterize human disease and to aid in diagnosis has shown great promise. However, this technique has not been much exploited for monitoring osteoporosis. MATERIALS AND METHODS: Swiss albino mice were sacrificed 2, 3, 4, and 5 wk after OVX and their femur bones were excised. The same protocol was used for age-matched female controls (no OVX). The LIF spectra from different regions of the bones were recorded and compared using PCA. RESULTS: A significant change in the fluorescence pattern of osteoporotic bones compared with the control was indicated by PCA match/no-match analysis. A region-wise PCA match/no-match analysis of the spectral changes against respective region calibration sets indicated more no-matches in the fifth week bones compared with the others. Further, the spectral differences were more prominent in the proximal and distal parts of the bones. In addition to the PCA, Gaussian curve fitting was also performed on control, third week, and fifth week bone spectra to identify different spectral components in them. CONCLUSION: This preliminary study using fluorescence spectroscopy in combination with PCA clearly demonstrated osteoporotic changes in mouse femur bones at different time points after OVX, suggesting possible human applications.


Subject(s)
Femur , Fluorescence , Osteoporosis/diagnosis , Ovariectomy , Spectrometry, Fluorescence/methods , Animals , Female , Lasers , Mice , Pilot Projects , Principal Component Analysis
14.
Photomed Laser Surg ; 27(4): 659-68, 2009 Aug.
Article in English | MEDLINE | ID: mdl-19514813

ABSTRACT

OBJECTIVE: The objective of this study was to verify the suitability of principal component analysis (PCA)-based k-nearest neighbor (k-NN) analysis for discriminating normal and malignant autofluorescence spectra of colonic mucosal tissues. BACKGROUND DATA: Autofluorescence spectroscopy, a noninvasive technique, has high specificity and sensitivity for discrimination of diseased and nondiseased colonic tissues. Previously, we assessed the efficacy of the technique on colonic data using PCA Match/No match and Artificial Neural Networks (ANNs) analyses. To improve the classification reliability, the present work was conducted using PCA-based k-NN analysis and was compared with previously obtained results. METHODS: A total of 115 fluorescence spectra (69 normal and 46 malignant) were recorded from 13 normal and 10 malignant colonic tissues with 325 nm pulsed laser excitation in the spectral region 350-600 nm in vitro. We applied PCA to extract the relevant information from the spectra and used a nonparametric k-NN analysis for classification. RESULTS: The normal and malignant spectra showed large variations in shape and intensity. Statistically significant differences were found between normal and malignant classes. The performance of the analysis was evaluated by calculating the statistical parameters specificity and sensitivity, which were found to be 100% and 91.3%, respectively. CONCLUSION: The results obtained in this study showed good discrimination between normal and malignant conditions using PCA-based k-NN analysis.


Subject(s)
Colonic Neoplasms/diagnosis , Intestinal Mucosa/anatomy & histology , Intestinal Mucosa/pathology , Principal Component Analysis , Spectrometry, Fluorescence , Algorithms , Cluster Analysis , Colon/anatomy & histology , Colon/pathology , Colonic Neoplasms/pathology , Humans , Lasers , Models, Statistical
15.
Photomed Laser Surg ; 27(2): 325-35, 2009 Apr.
Article in English | MEDLINE | ID: mdl-18800945

ABSTRACT

OBJECTIVE: The objective of this study is to evaluate the efficacy of laser-induced fluorescence (LIF) data obtained at 325-nm pulsed laser excitation for the discrimination of normal, benign, and malignant ovarian tissues. BACKGROUND DATA: Several studies have reported that the autofluorescence technique has a high specificity and sensitivity for discrimination between diseased and non-diseased tissues of various cancers, and also has the advantages of being non-invasive and producing a real-time diagnosis. When using this technique on ovarian tissues in most of the previously reported studies, multivariate statistical tools were used and classification analyses were carried out. MATERIALS AND METHODS: Autofluorescence spectra of normal, benign, and malignant ovarian tissues were recorded with 325-nm pulsed laser excitation in the spectral region from 350-600 nm in vitro. The spectral analysis for discrimination between the different types of tissues was carried out using principal component analysis (PCA)-based non-parametric k-nearest neighbor (k-NN) analysis. RESULTS: A total of 97 (34 normal, 33 benign, and 30 malignant) spectra were obtained from 22 subjects with normal, benign, and malignant tissues. The discrimination analysis of data using a PCA-based k-NN algorithm showed very good discrimination. The performance of the analysis was evaluated by calculating statistical parameters, specificity, sensitivity, and accuracy and were found to be 100%, 90.90%, and 94.2%, respectively. CONCLUSION: The results show that the discrimination of normal, benign, and malignant ovarian conditions can be achieved quite successfully using LIF.


Subject(s)
Endometriosis/diagnosis , Fluorescence , Low-Level Light Therapy , Ovarian Neoplasms/diagnosis , Ovary/radiation effects , Spectrometry, Fluorescence/methods , Algorithms , Female , Humans , Lasers , Ovary/pathology , Pilot Projects , Principal Component Analysis
16.
Acta Crystallogr Sect E Struct Rep Online ; 65(Pt 9): o2099-100, 2009 Aug 08.
Article in English | MEDLINE | ID: mdl-21577515

ABSTRACT

In the title compound, C(26)H(30)N(2)O(4)S·H(2)O, the pyrrolidine and dihydro-pyran rings adopt envelope conformations and they are cis-fused. The sulfonyl group has a distorted tetra-hedral geometry. In the crystal structure, the mol-ecules are linked into a ribbon-like structure along the a axis by O/C-H⋯O hydrogen bonds involving water mol-ecules and C-H⋯π inter-actions involving the sulfonyl-bound phenyl ring. Adjacent ribbons are cross-linked via C-H⋯O hydrogen bonds involving a sulfonyl O atom and C-H⋯π inter-actions involving the pyridinone ring.

17.
Acta Crystallogr Sect E Struct Rep Online ; 65(Pt 11): o2907-8, 2009 Oct 28.
Article in English | MEDLINE | ID: mdl-21578488

ABSTRACT

The mol-ecule of the title compound, C(31)H(31)N(3)O(5)S, adopts a folded conformation, with the sulfonyl-bound phenyl ring lying over the pyrimidine ring [dihedral angle = 12.04 (6)° and centroid-centroid separation = 3.6986 (8) Å]. The pyrrolidine ring adopts a twist conformation, the dihydro-pyran ring is in a half-chair conformation and the two rings are cis-fused. The tosyl group is attached to the pyrrolidine ring in an equatorial position while the benzyl group is axially attached. The mol-ecular structure is stabilized by weak C-H⋯O hydrogen bonds and C-H⋯π inter-actions. In the crystal, pairs of mol-ecules related by inversion symmetry are linked by C-H⋯O hydrogen bonds, forming chains propagating along the c axis which are cross-linked into a three-dimensional framework by further C-H⋯O links.

18.
Acta Crystallogr Sect E Struct Rep Online ; 65(Pt 11): o2923, 2009 Oct 31.
Article in English | MEDLINE | ID: mdl-21578501

ABSTRACT

In the title compound, C(31)H(30)N(2)O(2)S, the pyrrolidine ring adopts a twist conformation while the tetra-hydro-pyridine ring is in a half-chair conformation. The two rings are trans-fused. The pyridine-bound phenyl ring forms dihedral angles of 17.7 (1) and 48.1 (1)°, respectively, with the tosyl and benzyl phenyl rings. The mol-ecular structure is stabilized by an N-H⋯π inter-action involving the benzyl phenyl ring. In the crystal structure, mol-ecules translated by one unit along the a axis are linked into chains by C-H⋯π inter-actions involving the benzene ring of the tosyl group.

19.
Acta Crystallogr Sect E Struct Rep Online ; 65(Pt 11): o2924-5, 2009 Oct 31.
Article in English | MEDLINE | ID: mdl-21578502

ABSTRACT

In the title compound, C(32)H(32)N(2)O(2)S, the pyrrolidine ring adopts a twist conformation while the tetra-hydro-pyridine ring is in a distorted half-chair conformation. The two rings are trans-fused. The dihedral angle between the sulfonyl and benzyl phenyl rings is 72.54 (14)°. The mol-ecular structure is stabilized by C-H⋯O hydrogen bonds, and N-H⋯π inter-actions involving the benzyl phenyl ring. The screw-related mol-ecules are linked into chains along the b axis by C-H⋯O hydrogen bonds and C-H⋯π inter-actions. Adjacent inversion-related chains inter-act via C-H⋯π inter-actions, forming a two-dimensional network parallel to the bc plane.

20.
Acta Crystallogr Sect E Struct Rep Online ; 65(Pt 11): o2943-4, 2009 Oct 31.
Article in English | MEDLINE | ID: mdl-21578517

ABSTRACT

In the title compound, C(23)H(23)NO(5)S·0.125H(2)O, the pyrrolidine ring has a twist conformation and the dihydro-pyran ring adopts a half-chair conformation; the two rings are cis-fused. The mol-ecule adopts a folded conformation. The sulfonyl-bound phenyl ring and the pyran ring of the coumarin ring system are stacked over one another, with a centroid-centroid distance of 3.7470 (7) Å; the dihedral angle between the two rings is 18.93 (2)°. An intra-molecular C-H⋯O hydrogen bond is observed. The solvent water mol-ecule, lying on a twofold rotation axis, is only partially occupied with an occupancy of 0.125 (relative occupancy with respect to the main molecule) and is involved in O-H⋯O and C-H⋯O hydrogen bonding.

SELECTION OF CITATIONS
SEARCH DETAIL
...