Browse
Submit Data
Databases
API
Help

Dataset Information

10 Views

0 Connections

0 Citations

0 Reanalyses

0 Downloads

Omics score: 0

(2,2'-Bipyrid-yl)bis-[N-(2-hydroxy-ethyl)-N-n-propyl-dithio-carbamato-?S,S']cadmium(II) acetonitrile solvate.

ABSTRACT: The title complex, [Cd(C(6)H(12)NOS(2))(2)(C(10)H(8)N(2))]·CH(3)CN, features a distorted octa-hedral N(2)S(4) geometry for the Cd(II) centre defined by a pair of asymmetrically chelating dithio-carbamate ligands as well as a 2,2'-bipyridine ligand. Supra-molecular chains along [001] are formed in the crystal structure, mediated by O-H?S hydrogen bonds; the acetonitrile solvent mol-ecules are associated with the chains via O-H?N hydrogen bonds.

SUBMITTER: Song JC

PROVIDER: S-EPMC2971818 | biostudies-other | 2009

REPOSITORIES: biostudies-other

ACCESS DATA

Json Xml

Publications

(2,2'-Bipyrid-yl)bis-[N-(2-hydroxy-ethyl)-N-n-propyl-dithio-carbamato-κS,S']cadmium(II) acetonitrile solvate.

Song Juyoung C JC Tiekink Edward R T ER

Acta crystallographica. Section E, Structure reports online 20091125 Pt 12

The title complex, [Cd(C(6)H(12)NOS(2))(2)(C(10)H(8)N(2))]·CH(3)CN, features a distorted octa-hedral N(2)S(4) geometry for the Cd(II) centre defined by a pair of asymmetrically chelating dithio-carbamate ligands as well as a 2,2'-bipyridine ligand. Supra-molecular chains along [001] are formed in the crystal structure, mediated by O-H⋯S hydrogen bonds; the acetonitrile solvent mol-ecules are associated with the chains via O-H⋯N hydrogen bonds. ...[more]

PMID: 21578678

Similar Datasets

(2,2'-Bipyrid-yl)bis-[N,N-bis-(2-hydroxy-ethyl)dithio-carbamato-?S,S']cadmium(II).

Project description:The title compound, [Cd(C(5)H(10)NO(2)S(2))(2)(C(10)H(8)N(2))], features a trigonal-prismatic coordination geometry for the Cd(II) ion, based on an N(2)S(4) donor set defined by two chelating dithio-carbamate ligands and a 2,2'-bipyridyl ligand. In the crystal, extensive O-H?O hydrogen bonding results in the formation of 12-membered {?HO}(6) synthons and one-dimensional supra-molecular chains with further O-H?S inter-actions providing additional stability to the linear chain with base vector [01].

| S-EPMC2971885 | biostudies-other

(2,2'-Bipyridine-?N,N')bis-(N-ethyl-N-phenyl-dithio-carbamato-?S,S')cadmium(II) chloro-form solvate.

Project description:In the title compound, [Cd(C(9)H(10)NS(2))(2)(C(10)H(8)N(2))]·CHCl(3), the Cd(II) atom exists in an all-cis distorted octa-hedral geometry. Chelation is isobidentate for one dithio-carbamate ligand and anisobidentate for the other. The chloroform solvent mol-ecule is disordered over two positions of equal occupancy.

| S-EPMC2971268 | biostudies-other

Bis[N,N-bis-(2-hydroxy-ethyl)dithio-carbamato-κS,S']copper(II).

Project description:In the title compound, [Cu(C(5)H(10)NO(2)S(2))(2)], the Cu(II) cation is chelated by two bis-(2-hydroxy-ethyl)dithio-carbamate anions with a distorted square-planar coordination geometry. Inter-molecular O-H⋯O hydrogen bonding is observed between the terminal hydr-oxy groups in the crystal structure.

| S-EPMC2971934 | biostudies-literature

(2-Ethyl-2-oxazoline-?N)bis(N-ethyl-N-phenyl-dithio-carbamato-?(2)S,S')cadmium.

Project description:In the title compound, [Cd(C(9)H(10)NS(2))(2)(C(5)H(9)NO)], the Cd(II) atom is five-coordinated in a distorted square-pyramidal geometry by four S atoms from two chelating N-ethyl-N-phenyl dithio-carbamate ligands and one N atom from a 2-ethyl-2-oxazoline ligand. Inter-molecular C-H?? inter-actions are observed in the crystal structure.

| S-EPMC3470177 | biostudies-literature

(2,2'-Bipyridine-?N,N')bis-(N-isopropyl-N-methyl-dithio-carbamato-?S,S')cadmium.

Project description:The Cd(II) atom in the title compound, [Cd(C(5)H(10)NS(2))(2)(C(10)H(8)N(2))], exists in an N(2)S(4) donor set defined by two chelating dithio-carbamate anions as well as a 2,2'-bipyridine ligand. The coordination geometry approximates a trigonal prism. The crystal packing features weak C-H?S inter-actions, leading to linear supra-molecular chains along the a axis. The primary connections between these are by ?-? stacking inter-actions [ring centroid distance between centrosymmetrically related pyridyl rings = 3.7455?(10)?Å]. Overall, the crystal structure may be described as comprising double layers of mol-ecules that stack along the b axis.

| S-EPMC3089361 | biostudies-literature

(2,2'-Bipyridyl-?N,N')bis-(N-butyl-N-methyl-dithio-carbamato-?S,S')cadmium(II).

Project description:The Cd(II) atom in the title compound, [Cd(C(6)H(12)NS(2))(2)(C(10)H(8)N(2))], is hexa-coordinated by two dithio-carbamate ligands and the N atoms from a bidentate 2,2'-bipyridyl mol-ecule. The coordination geometry is based on a distorted trigonal-prismatic arrangement of the N(2)S(4) donor set. Supra-molecular chains, aligned along the a-axis direction, are mediated by C-H?S inter-actions and these are connected into layers that stack along the c axis via ?-? inter-actions [Cg(pyrid-yl)?Cg(pyrid-yl) = 3.6587?(13)?Å].

| S-EPMC3052129 | biostudies-literature

(2,2'-Bipyridine-κN,N')bis-(N-ethyl-N-methyl-dithio-carbamato-κS,S')zinc(II).

Project description:The complete mol-ecule of the title compound, [Zn(C(4)H(8)NS(2))(2)(C(10)H(8)N(2))], is generated by crystallographic twofold symmetry, with the Zn atom lying on the rotation axis; the axis also bis-ects the central C-C bond of the 2,2'-bipyridine mol-ecule. The metal atom is chelated by two S,S'-bidentate dithio-carbamate anions and the N,N'-bidentate heterocycle, resulting in a distorted cis-ZnN(2)S(4) octa-hedral geometry. The methyl and ethyl groups of the anion are statistically disordered.

| S-EPMC2979959 | biostudies-literature

Bis(N-isobutyl-N-propyl-dithio-carbamato-?S,S')zinc(II).

Project description:In the title compound, [Zn(C(8)H(16)NS(2))(2)], the Zn(II) atom is chelated by two S,S'-bidentate dithio-carbamate ions in a very distorted tetra-hedral geometry. The alkyl chains of the ligands are equally disordered over two sets of sites.

| S-EPMC2979964 | biostudies-literature

(?-2-Pyridine-aldazine-?N,N':N'',N''')bis-[bis-(N,N-di-n-propyl-dithio-carbamato-?S,S')cadmium(II)].

Project description:The dinuclear centrosymmetric title compound, [Cd(2)(C(7)H(14)NS(2))(4)(C(12)H(10)N(4))], features a tetra-dentate 2-pyridine-aldazine ligand that chelates two Cd centres. The coordination geometry for Cd is distorted octa-hedral based on a cis-N(2)S(4) donor set. In the crystal structure, mol-ecules are connected into a supra-molecular chain aligned along the a direction via C-H?S and C-H?? contacts, and by ?-? contacts [centroid-to-centroid distance 3.5708?(15)?Å]. The n-propyl groups are each disordered, one equally over two sites and the other with a site-occupancy factor of 0.618?(8) for the major component.

| S-EPMC2960527 | biostudies-literature

(Bipyridine-?(2)N,N')chlorido[N-(2-hydroxy-ethyl)-N-isopropyl-dithio-carbamato-?(2)S,S']zinc(II).

Project description:The Zn(II) atom in the title compound, [Zn(C(6)H(12)NOS(2))Cl(C(10)H(8)N(2))], is coordinated by a chelating N-2-hy-droxy-ethyl-N-isopropyl-dithio-carbamate ligand, a 2,2'-bipyridine ligand and a Cl atom. The resulting ClN(2)S(2) donor set defines a distorted square-pyramidal coordination geometry. Helical supra-molecular chains sustained by O-H?S hydrogen bonds and propagating along the b axis feature in the crystal packing. A three-dimensional architecture is stabilized by C-H?O, C-H?S and C-H?Cl inter-actions.

| S-EPMC3393212 | biostudies-literature

OmicsDI is part of the ELIXIR infrastructure

OmicsDI is an Elixir interoperability service. Learn more ›

OmicsDI Databases

PRIDE
PeptideAtlas
MassIVE
JPOST Repository
Physiome Model Repository

EGA
EVA
ENA
LINCS
PAXDB
Cell Collective

MetaboLights
Metabolomics Workbench
MetabolomeExpress
GNPS
BioModels
FAIRDOMHub

ArrayExpress
dbGaP
ExpressionAtlas
GEO
NODE

Information

Databases
Help
API
Contact us
Code on GitHub
Terms of use
Submit Data