Browse
Submit Data
Databases
API
Help

Dataset Information

20 Views

0 Connections

0 Citations

0 Reanalyses

0 Downloads

Omics score: 0

Bis(2,2'-bipyridyl-?N,N')(nitrato-?O,O')(trifluoro-acetato-?O)cadmium(II).

ABSTRACT: In the title complex, [Cd(C(2)F(3)O(2))(NO(3))(C(10)H(8)N(2))(2)], the Cd(II) ion is hepta-coordinated by two chelating 2,2'-bipyridyl ligands [Cd?N 2.370?(6)-2.416?(6)?Å], one carboxyl-ate O atom [Cd?O 2.290?(6)?Å] from the trifluoro-acetate ligand and two O atoms [Cd?O 2.386?(6), 2.633?(6)?Å] from a chelating nitrate anion. The trifluoro-methyl fragment is rotationally disordered between two orientations in a 0.640?(7):0.360?(7) ratio. In the crystal, weak inter-molecular C-H?O hydrogen bonds contribute to the crystal packing stability.

SUBMITTER: Duan W

PROVIDER: S-EPMC2969603 | biostudies-literature | 2009 May

REPOSITORIES: biostudies-literature

ACCESS DATA

Json Xml

Publications

Bis(2,2'-bipyridyl-κN,N')(nitrato-κO,O')(trifluoro-acetato-κO)cadmium(II).

Duan Wenzeng W Sun Junshan J Ma Yudao Y Wu Rentao R

Acta crystallographica. Section E, Structure reports online 20090514 Pt 6

In the title complex, [Cd(C(2)F(3)O(2))(NO(3))(C(10)H(8)N(2))(2)], the Cd(II) ion is hepta-coordinated by two chelating 2,2'-bipyridyl ligands [Cd⋯N 2.370 (6)-2.416 (6) Å], one carboxyl-ate O atom [Cd⋯O 2.290 (6) Å] from the trifluoro-acetate ligand and two O atoms [Cd⋯O 2.386 (6), 2.633 (6) Å] from a chelating nitrate anion. The trifluoro-methyl fragment is rotationally disordered between two orientations in a 0.640 (7):0.360 (7) ratio. In the crystal, weak inter-molecular C-H⋯O hydrogen bonds ...[more]

PMID: 21583003

Similar Datasets

Bis(?-2-phenyl-acetato-?O:O)bis-[(2,2'-bipyridyl-?N,N')(2-phenyl-acetato-?O)copper(II)] dihydrate.

Project description:The mol-ecule of the binuclear title complex, [Cu(2)(C(8)H(7)O(2))(4)(C(10)H(8)N(2))(2)]·2H(2)O, is located on an inversion centre. The Cu atoms are bridged by two O atoms of the monodentate phenyl-acetate groups [Cu-O = 1.9808?(14) and 2.3668?(14)?Å]. The longer of the two bridging Cu-O bonds takes the apical position of the distorted square-pyramidal environment of the Cu atom, which is completed by two N atoms of the chelate 2,2'-bipyridine ligand [Cu-N = 2.0107?(17) and 2.0234?(16)?Å]. The mol-ecules are assembled into stacks along [100] through ?-? inter-actions with inter-planar distances of 3.630?(4) and 3.407?(3)?Å; the resulting stacks are further connected into a three-dimensional supra-molecular architecture by O-H?O and C-H?O hydrogen-bonding inter-actions.

| S-EPMC3201355 | biostudies-literature

Bis[2-(benzimidazol-2-ylsulfan-yl)acetato]bis-(2,2'-bipyridine)cadmium(II).

Project description:In the structure of the title compound, [Cd(C(9)H(7)N(2)O(2)S)(2)(C(10)H(8)N(2))(2)], the complex mol-ecules are located on a crystallographic twofold rotation axis and the Cd(II) ion is octa-hedrally coordinated by two chelating 2,2'-bipyridine ligands and two O atoms from the carboxyl-ate groups of two 2-(benzimidazol-2-ylsulfan-yl)acetate ligands. The two carboxyl-ate ligands adopt a cis configuration with respect to each other. Within each of these ligands, the imidazole fragments are bent back in a loop towards the acetyl groups, forming intra-molecular N-H?O hydrogen bonds, which help to stablilize the mononuclear complex. Adjacent mol-ecules are further linked by weak C-H?O hydrogen bonds, resulting in a chain along the c axis.

| S-EPMC2971152 | biostudies-literature

Bis(2,2'-bipyridyl-?N,N')bis-(2-hydroxy-benzoato)-?O;?O,O-cadmium(II) methanol solvate.

Project description:The title compound, [Cd(C(7)H(5)O(3))(2)(C(10)H(8)N(2))(2)]·CH(3)OH, contains one monomeric seven-coordinate cadmium complex and one methanol solvate mol-ecule. The Cd(II) atom is coordinated to two 2,2'-bipyridyl ligands via the N atoms and to two salicylate anions (Hsal(-)) via the carboxyl-ate O atoms, which act as monodentate ligand for the one and bidentate ligand for the second. The Cd(II) atom exhibits a {6 + 1} environment, approximately described as a distorted capped octa-hedron with the apical positions occupied by one of the two N atoms belonging to one bipyridyl ligand and one of the two carboxyl-ate O atoms from the monodentate Hsal(-) ligand. Two intra-molecular six-membered hydrogen-bonded rings are present, generated from inter-actions between the carboxyl-ate and hydr-oxy groups of the salicylate ligands. There is one inter-molecular hydrogen-bonding inter-action involving the methanol solvent mol-ecule and the carboxyl-ate group from the monodentate Hsal(-) ligand. The crystal packing is governed by ?-? stacking inter-actions [centroid-centroid distance = 3.783?(4)?Å] which occur between bipyridyl ligands, by C-H?O and C-H?? inter-actions and by numerous van der Waals contacts.

| S-EPMC2979681 | biostudies-literature

(Acetato-κO)bis-(2,2'-bipyridyl-κN,N')copper(II)-ethyl sulfate-methyl sulfate (1/0.5/0.5).

Project description:In the title complex, [Cu(C(2)H(3)O(2))(C(10)H(8)N(2))(2)](CH(3)CH(2)OSO(3))(0.5)(CH(3)OSO(3))(0.5), the Cu(II) ion is bis-chelated by two 2,2'-bipyridine lignds and coordinated by an O atom of an acetate ligand in a CuN(4)O disorted square-pyramidal environment. In the structure, equal amounts of methyl sulfate and ethyl sulfate anions are disordered on the same crystallographic sites. The crystal structure is stabilized by weak inter-molecular C-H⋯O inter-actions.

| S-EPMC2959956 | biostudies-literature

?-Pyrazine-bis-[tetra-aqua-cadmium(II)] ?-pyrazine-bis-[tetra-acetato-cadmium(II)].

Project description:In the title dinuclear ionic complex, [Cd(2)(C(4)H(4)N(2))(H(2)O)(8)][Cd(2)(CH(3)CO(2))(8)(C(4)H(4)N(2))], the cation and anion are disordered equally over a site with symmetry mmm. The Cd(II) ions and the N atoms of the bridging pyrazine ligand lie on the inter-section of two crystallographic mirror planes. The C atoms of the bridging pyrazine ligand lie on one of these mirror planes, and the acetate groups and water mol-ecules lie across the inter-secting mirror planes. Each Cd(II) atom in the cation is five-coordinated by four O atoms from four water mol-ecules and one N atom from the bridging pyrazine ligand, whereas each Cd(II) in the anion is nine-coordinated by four pairs of O atoms from the bidentate acetate ligands and one N atom from the bridging pyrazine ligand. In the crystal structure, each anion is surrounded by eight nearest-neighbour cations and vice versa. The crystal structure is stabilized by ionic inter-actions as well as by C-H?O inter-actions.

| S-EPMC2961302 | 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

Bis(2,2'-bipyridyl-?(2)N,N')bis-(dicyanamido-?N)manganese(II).

Project description:In title complex, [Mn(C(2)N(3))(2)(C(10)H(8)N(2))(2)], the Mn(II) ion is coordinated in a slightly distorted octa-hedral geometry by six N atoms. Four of the N atoms are from two chelating bipyridine ligands and two are from a pair of cis-coordinated dicyanamide ligands. The dihedral angle formed by the mean planes of the bipyridine rings is 85.93?(14)°. The central N atom of one of the dicyanamide ligands was refined as disordered over two sites with equal occupancies.

| S-EPMC3344319 | biostudies-literature

Bis(1H-benzotriazole-4-sulfonato-?N,O)(2,2'-bipyridyl-?N,N')cadmium.

Project description:In the title complex, [Cd(C(6)H(4)N(3)O(3)S)(2)(C(10)H(8)N(2))], the Cd(2+) cation is located on a twofold rotation axis and is coordinated by two N and two O atoms from two symmetry-related benzotriazole-4-sulfonate anions and two N atoms from a 2,2-bipyridyl ligand, displaying a distorted CdN(4)O(2) octa-hedral geometry. The crystal structure is stabilized by N-H?O and C-H?O hydrogen-bonding inter-actions.

| S-EPMC3238624 | biostudies-literature

Bis(?-biphenyl-2,2'-dicarboxyl-ato)bis-[aqua-(2,2'-bipyridine)cadmium(II)].

Project description:In the centrosymmetric dinuclear mol-ecule of the title compound, [Cd(2)(C(14)H(8)O(4))(2)(C(10)H(8)N(2))(2)(H(2)O)(2)], the Cd(2+) ion is coordinated by three O atoms from two different diphenyl-dicarboxyl-ate (dpa) ligands (one O,O'-bidentate and one monodentate), a chelating bipyridine ligand and a water mol-ecule, generating an extremely distorted trigonal-prismatic (or irregular) CdN(2)O(4) coordination geometry for the metal ion. The bridging ligands generate an 18-membered ring, which is stabilized by two pairs of intra-molecular O-H?O hydrogen bonds.

| S-EPMC2979598 | biostudies-literature

Bis(2,2'-bipyridyl dioxide-?N,N')bis-(tricyano-methanido)cobalt(II) dihydrate.

Project description:In the title compound, [Co(C(4)N(3))(2)(C(10)H(8)N(2)O(2))]·2H(2)O, a novel tricyano-methanide complex, the Co(II) atom is located on an inversion center and has a distorted octa-hedral coordination with two 2,2'-bipyridyl dioxide (dpdo) mol-ecules and two trans tricyano-methanide (tcm) anions. The equatorial plane is formed by the four O atoms of the two chelating dpdo ligands, with one N atom of each of the two tcm ligands occupying an apical position. There is a disordered solvent water mol-ecule in the asymmetric unit (occupancy ratio 0.63:0.37). These water mol-ecules result in the formation of O-H?O and O-H?N hydrogen bonds, building a layer parallel to (100). The layers are linked by C-H?N hydrogen-bonding inter-actions, leading to a three-dimensional network.

| S-EPMC2979455 | 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