RESUMO
The whole mol-ecule of the title complex, [Hg2Cl4(C18H15N3)2], is generated by inversion symmetry. It was synthesized from the pyridine-derived Schiff base N-phenyl-N'-[(pyridin-2-yl)methyl-idene]benzene-1,4-di-amine (PPMBD). The five-coordinated Hg(2+) ions have a distorted square-pyramidal environment defined by two N atoms, viz. the imine and the other pyridyl [Hg-N = 2.467â (6) and 2.310â (6)â Å, respectively] belonging to the bidentate imino-pyridine ligand, and three Cl atoms [Hg-Cl = 2.407â (2), 2.447â (2) and 3.031â (2)â Å]. The longest Hg-Cl bond is bridging about the inversion centre. In the ligand, the central ring and pyridine ring are oriented at a dihedral angle of 8.1â (4)°, while the planes of the pyridine ring and the terminal phenyl ring are oriented at a dihedral angle of 53.8â (4)°. In the crystal, mol-ecules are linked by N-Hâ¯Cl and C-Hâ¯Cl hydrogen bonds, forming sheets parallel to (001).
RESUMO
In the mononuclear title complex, [HgCl2(C22H17N3)], synthesized from the quinoline-derived Schiff base N (1)-phenyl-N (4)-[(quinolin-2-yl)methyl-idene]benzene-1,4-di-amine (PQMBD) and HgCl2, the coordination sphere around the Hg(2+) atom is distorted tetra-hedral, comprising two Cl atoms [Hg-Cl = 2.3487â (14) and 2.4490â (15)â Å] and two N atom donors from the PQMBD ligand, viz. the quinolyl and the imine N atom [Hg-N = 2.270â (4) and 2.346â (4)â Å, respectively]. The dihedral angle between the two benzene rings attached to the amino group is 43.7â (3)°. In the crystal, N-Hâ¯Cl and C-Hâ¯Cl hydrogen bonds, as well as π-π stacking inter-actions between one phenyl ring and the pyridine ring of the quinoline moiety of an adjacent mol-ecule [centroid-to-centroid separation = 3.617â (4)â Å] are observed, resulting in a three-dimensional network.
RESUMO
In the title compound, C29H20N2, the dihedral angles subtended by the central p-phenyl-enedi-amine ring with respect to the mean plane of the terminal pyrenyl ring system (r.m.s. deviation = 0.027â Å) and the terminal N-phenyl ring are 29.34â (4) and 43.43â (7)°, respectively. The conformation about the C=N bond is E. In the crystal, mol-ecules are linked by N-Hâ¯π and C-Hâ¯π inter-actions forming chains propagating along the [10-2] direction. These chains are linked via π-π inter-actions [inter-centroid distances are in the range 3.5569â (11)-3.708â (1)â Å], forming slabs lying parallel to (30-4).
RESUMO
The title compound, [Ni(C7H6N2O3)(C12H8N2)2]·3.5H2O, crystallizes as a neutral mononuclear complex with 3.5 solvent water mol-ecules. One of the water mol-ecules lies on an inversion centre, so that its H atoms are disordered over two sites. The coordination environment of Ni(II) has a slightly distorted octa-hedral geometry, which is formed by one O and five N atoms belonging to the N,O-chelating pyrazol-1-ide-5-carboxyl-ate and two N,N'-chelating phenanthroline mol-ecules. In the crystal, O-Hâ¯O, N-Hâ¯O and O-Hâ¯N hydrogen bonds involving the solvent water mol-ecules and pyrazole-5-carboxyl-ate ligands form layers parallel to the ab plane. These layers are linked further via weak π-π inter-actions between two adjacent phenanthroline mol-ecules, with centroid-to-centroid distances in the range 3.886â (2)-4.018â (1)â Å, together with C-Hâ¯π contacts, forming a three-dimensional network.
RESUMO
In the title compound, (C5H6N)[Fe(NCS)4(C5H5N)2], the Fe(III) ion is coordinated by four thio-cyanate N atoms and two pyridine N atoms in a trans arrangement, forming an FeN6 polyhedron with a slightly distorted octa-hedral geometry. Charge balance is achieved by one pyridinium cation bound to the complex anion via N-Hâ¯S hydrogen bonding. The asymmetric unit consists of one Fe(III) cation, four thio-cyanate anions, two coordinated pyridine mol-ecules and one pyridinium cation. The structure exhibits π-π inter-actions between pyridine rings [centroid-centroid distances = 3.7267â (2), 3.7811â (2) and 3.8924â (2)â Å]. The N atom and a neighboring C atom of the pyridinium cation are statistically disordered with an occupancy ratio of 0.58â (2):0.42â (2).
RESUMO
In the title compound, [Cu(C7H6N2O3)(C6H8N2)(H2O)], the Cu(II) ion is in a distorted square-pyramidal N3O2 environment formed by two bidentate chelating ligands in the equatorial coordination sites and one water mol-ecule in the apical direction. In the crystal, O-Hâ¯O, N-Hâ¯O and O-Hâ¯N hydrogen bonds link the complex mol-ecules into a three-dimensional supra-molecular network.
RESUMO
In the mononuclear title complex, [Zn(C(10)H(8)N(2))(2)(C(2)H(6)OS)(2)](C(24)H(20)B)(2)·C(2)H(6)OS, the Zn(II) ion is coordinated by four N atoms of two bidentate 2,2'-bipyridine mol-ecules and by the O atoms of two cis-disposed dimethyl sulfoxide mol-ecules in a distorted octa-hedral geometry. The S atom and the methyl groups of one of the coordinated dimethyl sulfoxide mol-ecules are disordered in a 0.509â (2):0.491â (2) ratio. The crystal packing is stabilized by C-Hâ¯O hydrogen bonds between the dimethyl sulfoxide solvent mol-ecules and tetra-phenyl-borate anions.
RESUMO
In the title compound, [CoNa(2)(C(7)H(3)NO(4))(2)(H(2)O)(2)](n), the Co(II) atom is coordinated by two pyridine N atoms and four carboxyl-ate O atoms from two doubly deprotonated pyridine-2,6-dicarboxyl-ate ligands in a distorted octa-hedral geometry. One Na(+) cation is coordinated by three carboxyl-ate O atoms and two water mol-ecules and the other is coordinated by five carboxyl-ate O atoms and two water mol-ecules in an irregular geometry. The bis-(pyridine-2,6-dicarboxyl-ato)cobalt complex units are connected by Na(+) cations and bridging water mol-ecules into a three-dimensional coordination network. O-Hâ¯O hydrogen bonds are formed between the water mol-ecules and the carboxyl-ate O atoms.
RESUMO
The title structure, C(9)H(11)N(3)O(2), is a racemate. The chiral centre is situated at the N-C-N C atom of the imidazolidine ring. The inter-planar angle between the mean planes of the pyridine and imidazolidine rings is 89.41â (5)°. The methyl group is in a trans position with respect to the pyridine N atom. In the crystal, the mol-ecules are arranged in zigzag layers parallel to the b axis. The mol-ecules within the layers are inter-connected by strong O-Hâ¯N and weak N-Hâ¯O hydrogen bonds; the former take place between OH groups and amine N atoms and the latter between the amine N atom and the carbonyl O atom. In addition, C-Hâ¯O inter-actions are also present.
RESUMO
The crystal structure of the title compound, K(+)·C(3)H(4)NO(4) (-)·H(2)O, consists of potassium cations, monoanions of 2-carboxy-acetohydroxamic acid [namely 2-(N-hydroxy-carbamo-yl)acetate] and solvent water mol-ecules. The elements of the structure are united in a three-dimensional network by numerous Kâ¯O coordinate bonds and O-Hâ¯O and N-Hâ¯O hydrogen bonds. The coordination sphere of the K(+) ions may be described as a distorted double capped octa-hedron. Bond lengths and angles are similar to those in related compounds.
RESUMO
The mol-ecule of the title compound, C(14)H(12)N(2)O(4), lies across a crystallographic inversion centre situated at the mid-point of the C-C intra-annular bond. The mol-ecule is not planar, the dihedral angle between the aromatic rings being 50.1â (1)°. The oxime group is in an E position with respect to the -OH group and forms an intra-molecular O-Hâ¯N hydrogen bond. In the crystal structure, inter-molecular O-Hâ¯O hydrogen bonds link mol-ecules into chains propagating along [001]. The crystal structure is further stabilized by inter-molecular stacking inter-actions between the rings [centroid-to-centroid distance = 3.93â (1)â Å], resulting in layers parallel to the bc plane.