Browse
Submit Data
Databases
API
Help

Dataset Information

5 Views

0 Connections

0 Citations

0 Reanalyses

0 Downloads

Omics score: 0

(3,5-Dichloro-salicylaldehyde thio-semi-carbazonato-?S,N,O)(N,N'-dimethyl-formamide-?O)copper(II) dimethyl-formamide solvate.

ABSTRACT: In the title compound, [Cu(C(8)H(5)Cl(2)N(3)OS)(C(3)H(7)NO)]·C(3)H(7)NO, the Cu(II) atom is coordinated in a slightly distorted square-planar geometry by an O, an S and an N atom from the tridentate ligand 3,5-dichloro-salicylaldehyde thio-semi-carb-azonate ligand and one O atom from dimethyl-formamide. At the same time, the Cu atom is in contact with S and Cl atoms from another two complexes [Cu?S and Cu?Cl = 2.9791?(2) and 3.3800?(3)?Å, respectively], thereby forming a [4 + 2] coordination geometry. The crystal structure exhibits N-H?O and N-H?N hydrogen bonds.

SUBMITTER: Wang Y

PROVIDER: S-EPMC2961129 | biostudies-other | 2008

REPOSITORIES: biostudies-other

ACCESS DATA

Json Xml

Publications

(3,5-Dichloro-salicylaldehyde thio-semi-carbazonato-κS,N,O)(N,N'-dimethyl-formamide-κO)copper(II) dimethyl-formamide solvate.

Wang Yuan Y Liu Zheng Z Gao Jiong-Yang JY

Acta crystallographica. Section E, Structure reports online 20080410 Pt 5

In the title compound, [Cu(C(8)H(5)Cl(2)N(3)OS)(C(3)H(7)NO)]·C(3)H(7)NO, the Cu(II) atom is coordinated in a slightly distorted square-planar geometry by an O, an S and an N atom from the tridentate ligand 3,5-dichloro-salicylaldehyde thio-semi-carb-azonate ligand and one O atom from dimethyl-formamide. At the same time, the Cu atom is in contact with S and Cl atoms from another two complexes [Cu⋯S and Cu⋯Cl = 2.9791 (2) and 3.3800 (3) Å, respectively], thereby forming a [4 + 2] coordination geo ...[more]

PMID: 21202186

Similar Datasets

[(2S)-2-(3,5-Dichloro-2-oxidobenzyl-ideneamino)-3-(4-hydroxy-phen-yl)propionato-κO,N,O'](dimethyl-formamide-κO)copper(II).

Project description:In the title complex, [Cu(C(16)H(11)Cl(2)NO(4))(C(3)H(7)NO)] , the Cu(II) atom is coordinated by two O atoms and one N atom from the tridentate ligand L(2-) {LH(2) = (2S)-[2-(3,5-dichloro-2-hydroxy-benzyl-idene)-imino]-3-(4-hydroxy-phenyl)propionic acid} and one O atom from a dimethyl-formamide mol-ecule, resulting in a slightly distorted square-planar geometry. The structure forms a one-dimensional chain through weak coordination bonds [Cu⋯O 3.080 (1), Cu⋯Cl 3.269 (1) Å] and a three-dimensional network through O-H⋯O and C-H⋯O hydrogen bonds.

| S-EPMC2960937 | biostudies-literature

{2-[(3,5-Dichloro-2-oxidobenzyl-idene)amino-κN,O]-3-methyl-penta-noato-κO}(N,N'-dimethyl-formamide-κO)copper(II).

Project description:In the title compound, [Cu(C(13)H(13)Cl(2)NO(3))(C(3)H(7)NO)], the Cu(II) atom is coordinated in a slightly distorted square-planar geometry by two O atoms and one N atom from the tridentate chiral ligand 2-[(3,5-dichloro-2-oxidobenzyl-idene)amino]-3-methyl-penta-noate and by one O atom from dimethyl-formamide. In the crystal structure, the Cu atom forms contacts with Cl and O atoms of two units (Cu⋯Cl and Cu⋯O = 3.401 and 2.947 Å, respectively), thereby forming an approximately octa-hedral arrangement. A three-dimensional network is constructed through Cl⋯Cu, O⋯Cu, Cl⋯Cl contacts and C-H⋯O hydrogen bonds.

| S-EPMC2961092 | biostudies-literature

(E)-1-(3-Cyano-benzyl-idene)thio-semi-carbazide N,N-dimethyl-formamide solvate.

Project description:The title compound, C(9)H(8)N(4)S·C(3)H(7)NO, adopts an E configuration about both the C=N and C-N bonds. Inter-molecular N-H?O hydrogen bonding links the compound to the DMF solvent molecule. The crystal packing is characterized by chains of mol-ecules linked by inter-molecular N-H?S hydrogen-bonding inter-actions.

| S-EPMC2979889 | biostudies-other

1-(2,6-Dichloro-benzo-yl)-3-(3-nitro-phen-yl)thio-urea dimethyl-formamide solvate.

Project description:In the title compound, C(14)H(9)Cl(2)N(3)O(3)S·C(3)H(7)NO, the two aromatic rings enclose a dihedral angle of 32.93?(12)°. The thiourea mol-ecule exists in its thione form in the solid state with typical C=S and C-N bond lengths. In the crystal, N-H?O hydrogen bonds exist between the thio-urea and carbonyl groups on the same and neighboring mol-ecules. In addition, each dimethyl-formamide solvate mol-ecule forms a hydrogen bond to one N atom of the thio-urea group.

| S-EPMC2979807 | biostudies-other

Aqua-(3-formyl-2-oxidobenzoato-?O,O)(1,10-phenanthroline-?N,N')copper(II) dimethyl-formamide solvate.

Project description:In the structure of the title complex, [Cu(C(8)H(4)O(4))(C(12)H(8)N(2))(H(2)O)]·C(3)H(7)NO, the Cu(II) ion is penta-coordinated in a distorted square-pyramidal geometry by two O atoms of a 3-formyl-2-oxidobenzoate dianion and two N atoms of a 1,10-phenanthroline ligand occupying the basal plane and a water O atom located at the apical site. The structure displays O-H?O hydrogen bonding and inter-molecular ?-? stacking inter-actions between 1,10-phenantroline ligands [inter-planar distance of 3.448?(5)?Å].

| S-EPMC2977551 | biostudies-literature

(Dimethyl-formamide-?O){4,4',6,6'-tetra-bromo-2,2'-[o-phenyl-enebis(nitrilo-methyl-idyne)]diphenolato-?O,N,N',O'}copper(II) dimethyl-formamide solvate.

Project description:In the title compound, [Cu(C(20)H(10)Br(4)N(2)O(2))(C(3)H(7)NO)]·C(3)H(7)NO, the Cu(II) ion is coordinated by two N atoms and two O atoms from a tetra-dentate Schiff base ligand and the O atom of one dimethyl-formamide ligand in an almost square-pyramidal geometry. The uncoordinated dimethyl-formamide solvent mol-ecule is disordered over two sets of positions with occupancies of 0.741?(4) and 0.259?(4). The crystal packing is stabilized by C-H?O inter-actions.

| S-EPMC2969304 | biostudies-literature

Hexa-kis-(dimethyl-formamide-?O)manganese(II) (dimethyl-formamide-?O)pentakis(-thio-cyanato--?N)chromate(III).

Project description:The title compound, [Mn(C(3)H(7)NO)(6)][Cr(NCS)(5)(C(3)H(7)NO)], was obtained unintentionally as a product of an attempted synthesis of heterometallic complexes based on Reineckes anion using manganese powder, Reineckes salt and 1-(2-hy-droxy-eth-yl)tetra-zole as starting materials. The crystal structure of the complex consists of an [Mn(dmf)(6)](2+) cation and a [Cr(NCS)(5)(dmf)](2-) anion (dmf = dimethyl-formamide). The Mn(II) and Cr(III) atoms show a slightly distorted octa-hedral MnO(6) and CrN(5)O coordination geometries with adjacent angles in the range 85.29?(13)-95.96?(14)°.

| S-EPMC3379144 | biostudies-literature

Acetoguanamine N,N-dimethyl-formamide solvate.

Project description:The structure of acetoguanamine (or 2,4-diamino-6-methyl-1,3,5-triazine) has been determined as the N,N-dimethyl-formamide solvate, C(4)H(7)N(5)·C(3)H(7)NO. The mol-ecular components are associated in the crystal structure to form ribbons stabilized by three N-H?N and one N-H?O hydrogen bonds which involve NH groups as donors and the N atoms of the heterocyclic ring and the carbonyl O atom of the solvent as acceptors.

| S-EPMC2960528 | biostudies-literature

Chloridotris(3,5-dimethyl-1H-pyrazole-?N)(formato-?O)copper(II)-dichlorido-bis(3,5-dimethyl-1H-pyrazole-?N)copper(II) (2/1).

Project description:The asymmetric unit of the title compound, [Cu(CHO(2))Cl(C(5)H(8)N(2))(3)](2)·[CuCl(2)(C(5)H(8)N(2))(2)] or 2[A]·[B], contains one A mol-ecule and one half-molecule of B, located on a centre of inversion. The Cu(II) environments in A and B are different. In A, the Cu(II) atom is coordinated by three N atoms from three 3,5-dimethyl-1H-pyrazole (L) ligands, one O atom from a formate ligand and a chloride anion in an axial position [Cu-Cl = 2.4275?(7)?Å] in a distorted tetra-gonal-pyramidal geometry. The Cu(II) atom in B is coordinated by two N atoms from two L ligands and two chloride anions [Cu-Cl = 2.2524?(6)?Å] in a distorted square-planar geometry. In the crystal, inter-molecular N-H?O hydrogen bonds link mol-ecules A into centrosymmetric dimers. Inter-molecular N-H?Cl hydrogen bonds further link these dimers with the B mol-ecules, forming chains propagating in [101].

| S-EPMC3120383 | biostudies-literature

Dibromido[1,1'-dibenzyl-2,2'-(sulfane-diyl-dimethyl-ene)di-1H-benzimidazole]-cadmium(II) dimethyl-formamide solvate.

Project description:In the title compound, [CdBr(2)(C(30)H(26)N(4)S)]·C(3)H(7)NO, both the complex and solvent mol-ecule lie on a crystallographic mirror plane. The Cd(II) ion is coordinated in a disorted square-pyramidal CdBr(2)N(2)S environment with one of the Br atoms in the apical site. In the crystal structure, the benzimidazole ring systems are involved in weak inter-molecular ?-? stacking inter-actions [centroid-centroid distances = 3.606?(2) and 3.753?(2)?Å]. Further stabilization is provided by weak inter-molecular C-H?O hydrogen bonds. The methyl H atoms of the dimethyl-formamide solvent mol-ecule are disordered about a mirror plane.

| S-EPMC3007206 | 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