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1.
Acta Crystallogr Sect E Struct Rep Online ; 67(Pt 1): o225, 2010 Dec 24.
Article in English | MEDLINE | ID: mdl-21522724

ABSTRACT

In the title compound, C(11)H(14)N(2)O(2), the urea-type NC=ON moiety [planar to within 0.0002 (13) Å] is inclined to the phenyl ring by 42.88 (8) Å, and the morpholine ring has a chair conformation. In the crystal, inter-molecular N-H⋯O hydrogen bonds link the mol-ecules into infinite chains in [001].

2.
Acta Crystallogr Sect E Struct Rep Online ; 67(Pt 1): o226, 2010 Dec 24.
Article in English | MEDLINE | ID: mdl-21522725

ABSTRACT

In the title compound, C(17)H(20)N(2)O(2)S, the tetra-hydro-pyridine ring adopts an envelope conformation with the N atom at the flap position; the phenyl ring makes a dihedral angle of 81.06 (10)° with the thio-phene ring. The amino group links with the carbonyl O atom via intra-molecular N-H⋯O hydrogen bonding, forming a six-membered ring. In the crystal, inter-molecular N-H⋯O hydrogen bonds link the mol-ecules into infinite chains running along the b axis.

3.
Acta Crystallogr Sect E Struct Rep Online ; 66(Pt 9): o2403, 2010 Aug 25.
Article in English | MEDLINE | ID: mdl-21588734

ABSTRACT

In the title compound, C(19)H(19)N(3)OS(2), the thio-pyran ring adopts a twist-chair conformation and the pyrimidinone unit is essentially planar, with a mean deviation of 0.0497 Å. The thio-phene ring is essentially planar with a maximum deviation of 0.024 (2) Å, while the pyrrolidine ring exhibits an envelope conformation. The pyrimidinone and thio-phene rings are almost coplanar, forming a dihedral angle of 6.31 (15)°, while the dihedral angle between the mean planes of the phenyl ring and the pyrimidinone ring is 68.13 (10)°. In the crystal structure, adjacent mol-ecules are linked by C-H⋯O hydrogen bonds, forming a two-dimensional network in the ac plane.

4.
Acta Crystallogr Sect E Struct Rep Online ; 65(Pt 11): m1488-9, 2009 Oct 31.
Article in English | MEDLINE | ID: mdl-21578210

ABSTRACT

In the title salt, [Cu(NCS)(C(6)H(6)N(4))(2)]Cl, the Cu(II) atom adopts a five-coordinated square-pyramidal geometry consisting of an N atom from a thio-cyanate anion and four N atoms from two chealting biimidazole ligands. The thio-cyanate ligand occupies the axial position and is, like the Cu(II) centre, located on a mirror plane. The cation and anion are linked into a linear chain by N-H⋯S and N-H⋯Cl hydrogen bonds.

5.
Acta Crystallogr Sect E Struct Rep Online ; 65(Pt 7): o1618, 2009 Jun 20.
Article in English | MEDLINE | ID: mdl-21582888

ABSTRACT

The title compound, C(13)H(16)N(2)O(3), adopts an E configuration with respect to the C=N bond and an intra-molecular N-H⋯N hydrogen bond results in the formation of a six-membered ring. In the crystal, inter-molecular O-H⋯O hydrogen bonds link the mol-ecules into a chain propagating along the b axis. Very weak π-π stacking inter-actions [centroid-centroid distance = 4.18 (2) Å] may further consolidate the packing, forming a two-dimensional supra-molecular network.

6.
Acta Crystallogr Sect E Struct Rep Online ; 64(Pt 11): m1363, 2008 Oct 04.
Article in English | MEDLINE | ID: mdl-21580823

ABSTRACT

In the title complex, [Mn(C(5)H(7)O(2))(2)(NCS)(CH(4)O)], the Mn(III) atom has a slightly distorted octa-hedral coordination formed by five O atoms and one N atom. The equatorial positions are occupied by four O atoms of two acetyl-acetonate ligands, while the axial positions are occupied by the N atom of the thio-cyanate anion and the O atom of the methanol mol-ecule. In the crystal structure, complex mol-ecules are linked by an inter-molecular O-H⋯S hydrogen bond, forming a chain running along [101].

7.
Acta Crystallogr Sect E Struct Rep Online ; 64(Pt 11): m1431, 2008 Oct 18.
Article in English | MEDLINE | ID: mdl-21580874

ABSTRACT

In the title compound, [Ni(C(8)H(4)O(4))(C(36)H(44)N(4)O(4))](n), the Ni(II) atom is coordinated in a distorted octa-hedral geometry by the four N atoms of the 1,12,15,26-tetra-aza-5,8,19,22-tetra-oxa-3,4:9,10:17,18:23,24-tetra-benzocyclo-octa-cosane ligand and two O atoms from the terephthalate dianions. The Ni(II) atoms, which lie on inversion centres, are linked via terephthalate ligands to form a chain structure along [101]. The structure is stabilized by three intra-molecular and one inter-molecular N-H⋯O hydrogen bonds.

8.
Acta Crystallogr Sect E Struct Rep Online ; 64(Pt 11): o2114, 2008 Oct 15.
Article in English | MEDLINE | ID: mdl-21580978

ABSTRACT

In the title mol-ecule, C(18)H(17)N(3)O(3), the dihedral angle between the mean planes of the furan ring and the quinoline group is 77.4 (2)°. In the crystal structure, inter-molecular N-H⋯N hydrogen bonds link the mol-ecules into centrosymmetric dimers.

9.
Acta Crystallogr Sect E Struct Rep Online ; 64(Pt 12): o2434, 2008 Nov 26.
Article in English | MEDLINE | ID: mdl-21581402

ABSTRACT

In the title compound, C(20)H(21)N(3)OS(2), the piperidinyl ring has a distorted chair conformation. Weak inter-molecular C-H⋯O hydrogen bonds link the mol-ecules into centrosymmetric dimers. The crystal packing exhibits short inter-molecular S⋯S distances of 3.590 (2) Å.

10.
Acta Crystallogr Sect E Struct Rep Online ; 64(Pt 6): m795, 2008 May 10.
Article in English | MEDLINE | ID: mdl-21202483

ABSTRACT

In the crystal structure of the title compound, [Co(C(2)H(4)NO(2))(C(9)H(6)NO)(2)]·CH(3)OH, the Co(III) atom is chelated by two quinolin-8-olate and one glycinate anions in a distorted octa-hedral coordination geometry. The five-membered chelating glycinate ring assumes an envelope conformation. The complex mol-ecules are assembled by inter-molecular N-H⋯O hydrogen bonding.

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