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Catena-Poly[(?-2-amino-1,3,4-thia-diazole-?N:N)di-?-chlorido-cadmium].

ABSTRACT: In the title coordination polymer, [CdCl(2)(C(2)H(3)N(3)S)](n), the Cd(II) cation is coordinated by four Cl(-) anions and two N atoms from two trans 2-amino-1,3,4-thia-diazole (L) ligands in a distorted octa-hedral geometry. The L ligand and Cl(-) anions bridge adjacent Cd cations, forming a polymeric chain along the b axis; the separation between adjacent Cd cations is 3.619?(1)?Å. In the crystal, the polymeric chains are inter-linking through N-H?Cl hydrogen bonds between the L ligands and Cl(-) anions.

SUBMITTER: Suen MC

PROVIDER: S-EPMC3212157 | biostudies-literature | 2011 Aug

REPOSITORIES: biostudies-literature

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catena-Poly[(μ-2-amino-1,3,4-thia-diazole-κN:N)di-μ-chlorido-cadmium].

Suen Maw-Cherng MC Yeh Chun-Wei CW Jou Chi-Hsiung CH

Acta crystallographica. Section E, Structure reports online 20110713 Pt 8

In the title coordination polymer, [CdCl(2)(C(2)H(3)N(3)S)](n), the Cd(II) cation is coordinated by four Cl(-) anions and two N atoms from two trans 2-amino-1,3,4-thia-diazole (L) ligands in a distorted octa-hedral geometry. The L ligand and Cl(-) anions bridge adjacent Cd cations, forming a polymeric chain along the b axis; the separation between adjacent Cd cations is 3.619 (1) Å. In the crystal, the polymeric chains are inter-linking through N-H⋯Cl hydrogen bonds between the L ligands and Cl( ...[more]

PMID: 22090859

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catena-Poly[[dichloridozinc(II)]-μ-2,5-di-4-pyridyl-1,3,4-thia-diazole-κN:N].

Project description:The title compound, [ZnCl(2)(C(12)H(8)N(4)S)](n), was obtained by crystallization of 2,5-di-4-pyridyl-1,3,4-thia-diazole with ZnCl(2) in an MeOH/CHCl(3) solvent system. The structure contains infinite chains of ZnCl(2) units connected by the bifunctional thia-diazole ligands, with Zn(II) adopting a distorted tetra-hedral coordination geometry. The dihedral angle between the two pyridyl rings in each ligand is 34.3 (1)°, and the dihedral angles between the thia-diazole ring and the two pyridyl rings are 18.3 (2) and 16.1 (2)°. The shortest Zn⋯Zn distance within each polymeric chain is 11.862 (3) Å, while the shortest inter-chain Zn⋯Zn distance is 7.057 (3) Å.

| S-EPMC2960333 | biostudies-literature

catena-Poly[(dichloridocadmium)-di-?-chlorido-[bis-(morpholinium-?O)cadmium]-di-?-chlorido].

Project description:In the title compound, [Cd(2)Cl(6)(C(4)H(10)NO)(2)](n), the coordination geometry of each Cd(II) ion is distorted octa-hedral, but with quite different coordination environments. One Cd(II) atom is coordinated by four Cl atoms and two O atoms from two morpholinium ligands, while the other is coordinated by six Cl atoms. Adjacent Cd(II) atoms are inter-connected alternately by paired chloride bridges, generating a chain parallel to the a axis. Inter-chain N-H?Cl inter-actions form a two-dimensional network.

| S-EPMC3212201 | biostudies-literature

catena-Poly[[bis-(nitrato-κO,O')copper(II)]-μ-2,2'-(ethane-1,2-diyldithio)di-1,3,4-thia-diazole-κN:N].

Project description:In the title compound, [Cu(NO(3))(2)(C(6)H(6)N(4)S(4))](n), the Cu(II) atom, occupying a crystallographic inversion centre, is six-coordinated by two N atoms of two 2,2'-[1,2-ethane-diyl-bis-(thio)]bis-[1,3,4-thia-diazole] ligands in trans positions, and four O atoms from two symmetry-related opposite nitrate anions, which are asymmetrically bonded, resulting in a strong distorted octa-hedral geometry of the central atom. The ethane group is equally disordered over two sites via another inversion centre. The bridging bidentate 2,2'-[1,2-ethanediylbis(thio)]bis-[1,3,4-thia-diazole] ligands link the Cu(II) centres into a one-dimensional chain. The chains are inter-connected via inter-molecular S⋯O inter-actions [3.044 (4) and 3.084 (5) Å] and weak C-H⋯O hydrogen bonds, generating a three-dimensional supra-molecular structure.

| S-EPMC2967916 | biostudies-literature

catena-Poly[cadmium-?-[1,3-bis-(imidazol-1-yl)propane]-di-?-chlorido].

Project description:The title complex, [CdCl(2)(C(9)H(12)N(4))](n), is characterized by the formation of a zigzag chain structure parallel to [001]. In the chain, the Cd(2+) cation is coordinated by four bridging Cl(-) ligands in equatorial positions and two N atoms from symmetry-related and likewise bridging 1,3-bis-(imidazol-1-yl)propane ligands in axial positions, forming a distorted CdCl(4)N(2) octa-hedron.

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catena-Poly[[[bis-[2,2'-(propane-1,3-diyl-dithio)bis-(1,3,4-thia-diazole)-?N]copper(II)]-bis-[?-2,2'-(propane-1,3-diyldithio)bis-(1,3,4-thia-diazole)-?N:N]] bis-(perchlorate)].

Project description:In the title compound, {[Cu(C(7)H(8)N(4)S(4))(4)](ClO(4))(2)}(n), the Cu(II) atom, occupying a crystallographic inversion centre, is six-coordinated by six N atoms of three symmetry-related 2,2'-(propane-1,3-diyldithio)bis-(1,3,4-thia-diazole) (L) ligands in a slightly distorted octa-hedral geometry. The ligand L adopts two kinds of coordination modes in the crystal structure; one is a monodentate coordination mode and serves to complete the octa-hedral coordination of the Cu atom and the other is an N:N'-bidentate bridging mode in a trans configuration, bridging Cu atoms via translation symmetry along the b axis into a chain structure. The perchlorate ions serve as acceptors for inter-molecular C-H?O hydrogen bonds, which link the chains into a three-dimensional network.

| S-EPMC2968698 | biostudies-literature

5,5'-Diethyl-2,2'-(triazene-1,3-di-yl)di-1,3,4-thia-diazole.

Project description:In the mol-ecule of the title compound, C(8)H(11)N(7)S(2), the conformation about the N=N bond is trans and the thia-diazole rings are oriented at a dihedral angle of 2.92?(3)°. In the crystal structure, inter-molecular N-H?S hydrogen bonds link the mol-ecules into chains. There are ?-? contacts between the thia-diazole rings [centroid-to-centroid distances = 3.699?(3) and 3.720?(2)?Å].

| S-EPMC2959579 | biostudies-literature

catena-Poly[[bis[quinazolin-4(3H)-one-?N]cadmium(II)]-di-?-chlorido].

Project description:The asymmetric unit of the title compound, [CdCl(2)(C(8)H(6)N(2)O)(2)](n), consists of one mol-ecule of the 3H-quinazolin-4-one ligand, one Cd(2+) cation, which is located on a twofold axis, and one chlorido ligand in a general position. The latter bridges metal cations, forming a one-dimensional polymer along the b axis. The Cd?Cd distance along the chain is 3.7309?(7)?Å. The octa-hedral coordination around the metal is completed by two ligands in a trans axial geometry which coordinate through the N atom in 1 position. Moderately strong classical N-H?O hydrogen bonds around crystallographic inversion centers cross-link adjacent polymeric chains.

| S-EPMC3009324 | biostudies-literature

catena-Poly[[(5,5'-dimethyl- 2,2'-bipyridine-?N,N')cadmium(II)]-di-?-chlorido].

Project description:The asymmetric unit of the title compound, [CdCl(2)(C(12)H(12)N(2))](n), contains one half-mol-ecule; a twofold rotation axis passes through the Cd atom. The Cd(II) atom is six-coordinated in a distorted octa-hedral configuration by two N atoms from 2,2'-bipyridine-5,5'-dimethyl and four bridging Cl atoms. The bridging function of the chloro atoms leads to a one-dimensional chain structure. There is a ?-? contact between the pyridine rings [centroid-centroid distance = 3.9807?(9)?Å].

| S-EPMC2959444 | biostudies-literature

catena-Poly[[trans-bis-(1,3-benzo-thia-zole-?N)manganese(II)]-di-?-chlorido].

Project description:In the title coordination polymer, [MnCl2(C7H5NS)2] n , the Mn(II) ion is located on the inter-section of a twofold rotation axis and a mirror plane and adopts an octa-hedral coordination geometry defined by two mutually trans N atoms from benzo-thia-zole ligands which occupy the axial positions, and four Cl atoms which form the equatorial sites. The Mn(II) ions are connected by two bridging Cl atoms, forming chains parallel to the c axis. The crystal packing can be descibed as alternating layers parallel to (001) featuring ?-? stacking inter-actions with a centroid-centroid distance of 3.6029?(15)?Å.

| S-EPMC4120608 | biostudies-literature

catena-Poly[[(3-methyl-sulfanyl-1,2,4-thia-diazole-5-thiol-ato)sodium]di-?-aqua-?O:O].

Project description:The crystal structure of the title compound, [Na(C(3)H(3)N(2)S(3))(H(2)O)(2)](n), features polymeric chains made up of O?O edge-shared NaSN(H(2)O)(4) units running along the b axis. The Na(+) ion and all non-H atoms of the thia-diazole ligand lie on a mirror plane.

| S-EPMC2980197 | biostudies-literature

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