Browse
Submit Data
Databases
API
Help

Dataset Information

14 Views

0 Connections

0 Citations

0 Reanalyses

0 Downloads

Omics score: 0

Di-aqua-bis-(pyridine-2-carboxyl-ato-?(2) N,O)zinc di-methyl-formamide hemisolvate.

ABSTRACT: In the title compound, [Zn(C6H4NO2)2(H2O)2]·0.5C3H7NO, the Zn(II) ion is coordinated in a distorted octa-hedral N2O4 environment by two N,O-chelating pyridine-2-carboxyl-ate ligands and two cis water mol-ecules. The chelating pyridine-2-carboxyl-ate ligands create two five-membered Zn/N/C/C/O rings, which form a dihedral angle of 86.4?(2)°. In the crystal, O-H?O hydrogen bonds link the complex mol-ecules into a two-dimensional network parallel to (100). The di-methyl-formamide solvent mol-ecule is disordered about a twofold rotation axis.

SUBMITTER: Croitor L

PROVIDER: S-EPMC3793690 | biostudies-literature | 2013

REPOSITORIES: biostudies-literature

ACCESS DATA

Json Xml

Publications

Di-aqua-bis-(pyridine-2-carboxyl-ato-κ(2) N,O)zinc di-methyl-formamide hemisolvate.

Croitor Lilia L Chisca Diana D Coropceanu Eduard B EB Fonari Marina S MS

Acta crystallographica. Section E, Structure reports online 20130713 Pt 8

In the title compound, [Zn(C6H4NO2)2(H2O)2]·0.5C3H7NO, the Zn(II) ion is coordinated in a distorted octa-hedral N2O4 environment by two N,O-chelating pyridine-2-carboxyl-ate ligands and two cis water mol-ecules. The chelating pyridine-2-carboxyl-ate ligands create two five-membered Zn/N/C/C/O rings, which form a dihedral angle of 86.4 (2)°. In the crystal, O-H⋯O hydrogen bonds link the complex mol-ecules into a two-dimensional network parallel to (100). The di-methyl-formamide solvent mol-ecule ...[more]

PMID: 24109277

Similar Datasets

Diaqua-bis-(pyridine-2-carboxyl-ato-κN,O)manganese(II) dimethyl-formamide hemisolvate.

Project description:There are two crystallographically independent complex mol-ecules with very similar geometries in the unit cell of the title compound, [Mn(C(6)H(4)NO(2))(2)(H(2)O)(2)]·0.5C(3)H(7)NO. The central ion is situated in a distorted octa-hedral environment of two N- and four O-donor atoms from two pyridine-2-carboxyl-ate ligands and two cis-disposed water mol-ecules. The carboxyl-ate ligands are coordinated in a chelate fashion with the formation of two five-membered rings. In the crystal, the complex mol-ecules are connected by O-H⋯O hydrogen bonds between the coordinated water mol-ecules and the uncoordinated carboxyl-ate O atoms, thus forming hydrogen-bonded walls disposed perpendicularly to the bc plane.

| S-EPMC3246979 | biostudies-literature

Aqua-bis-(5-butyl-pyridine-2-carboxyl-ato)zinc monohydrate.

Project description:In the title complex, [Zn(C(10)H(12)NO(2))(2)(H(2)O)]·H(2)O, the Zn(II) ion is coordinated by two N and two O atoms from two 5-n-butyl-pyridine-2-carboxyl-ato ligands and one O atom from a water mol-ecule in a distorted square-pyramidal geometry. In the crystal, inter-molecular O-H?O hydrogen bonds link mol-ecules into a two-dimensional supramolecular structure parallel to (001).

| S-EPMC3151896 | biostudies-literature

Crystal structure of poly[di-aqua-bis-(?5-benzene-1,3-di-carboxyl-ato)(N,N-di-methyl-formamide)-cadmium(II)disodium(I)].

Project description:The title compound, [CdNa2(C8H4O4)2(C3H7NO)(H2O)2] n or [CdNa2(1,3-bdc)2(DMF)(H2O)2] n , is a new CdII-NaI heterobimetallic coordination polymer. The asymmetric unit consists of one CdII atom, two NaI atoms, two 1,3-bdc ligands, two coordinated water mol-ecules and one coordinated DMF mol-ecule. The CdII atom exhibits a seven-coordinate geometry, while the NaI atoms can be considered to be penta-coordinate. The metal ions and their symmetry-related equivalents are connected via chelating-bridging carboxyl-ate groups of the 1,3-bdc ligands to generate a three-dimensional framework. In the crystal, there are classical O-H?O hydrogen bonds involving the coordinated water mol-ecules and the 1,3-bdc carboxyl-ate groups and ?-? stacking between the benzene rings of the 1,3-bdc ligands present within the frameworks.

| S-EPMC5683472 | biostudies-literature

Tetra-aqua-bis(3-fluoro-pyridine-4-carboxyl-ato-?N)zinc(II) dihydrate.

Project description:In the title compound, [Zn(C(6)H(3)FNO(2))(2)(H(2)O)(4)]·2H(2)O, the Zn(II) atom is octa-hedrally coordinated in a ZnO(4)N(2) environment by two 3-fluoro-pyridine-4-carboxyl-ate (3-fpy4-cbx) ligands and four water mol-ecules. The [Zn(3-fpy4-cbx)(2)(H(2)O)(4)] mol-ecules form a three-dimensional network through strong O-H?O and weak O-H?F hydrogen bonds between 3-fpy4-cbx and water mol-ecules. The crystal used for data collection was a twin, with the twin law corresponding to a 180° rotation about the real-space [001] axis. The major twin fraction refined to 0.795?(1).

| S-EPMC2983599 | biostudies-literature

Diaqua-bis(5-methyl-pyridine-2-carboxyl-ato-?N,O)zinc(II).

Project description:In the title compound, [Zn(C(7)H(6)NO(2))(2)(H(2)O)(2)], the Zn atom (site symmetry ) adopts a distorted trans-ZnN(2)O(4) octa-hedral coordination arising from two N,O-bidentate 5-methyl-pyridine-2-carboxyl-ate ligands and two water mol-ecules. In the crystal structure, mol-ecules form a layered network linked by O-H?O hydrogen bonds.

| S-EPMC2968010 | biostudies-literature

Tetra-aqua-bis-(1H-benzimidazole-5,6-di-carboxyl-ato-?N)cobalt(II) dimethyl-formamide disolvate dihydrate.

Project description:In the mononuclear title compound, [Co(C(9)H(4)N(2)O(4))(2)(H(2)O)(4)]·2C(3)H(7)NO·2H(2)O, the Co(II) atom, which lies on a center of inversion, is coordinated by four water mol-ecules and two N atoms from two two symmetry-related 1H-benzimidazole-5,6-dicarboxyl-ate ligands in a distorted octa-hedral geometry. The packing is governed by inter-molecular O-H?O and N-H?O hydrogen-bonding inter-actions.

| S-EPMC2971142 | biostudies-literature

Guanidinium hexa-aqua-zinc(II) bis[tris-(3-carb-oxy-pyridine-2-carboxyl-ato)zincate].

Project description:In the title mol-ecular salt, (CH(6)N(3))(1.30)[Zn(H(2)O)(6)](0.35)[Zn(C(7)H(4)NO(4))(3)](2), the Zn(II) atom (site symmetry 3) in the anion is coordinated by three N,O-bidentate 3-carb-oxy-pyridine-2-carboxyl-ate monoanions to generate a fac-ZnN(3)O(3) octa-hedral coordination geometry. The guanidinium cation (the C atom has site symmetry 3) and the octa-hedral hexa-aqua-zinc(II) dication (the Zn(2+) cation has site symmetry -3) are occupationally disordered in a 1.30:0.35 ratio. In the crystal, the components are linked by O-H?O and N-H?O hydrogen bonds to generate infinite (001) sheets. Weak aromatic ?-? stacking [centroid-centroid distance = 3.797?(8)?Å] is also observed in the crystal.

| S-EPMC3414107 | biostudies-literature

Bis-(?-pyridine-2,3-dicarboxyl-ato)bis-[aqua-(3-carb-oxy-pyridine-2-carboxyl-ato)indium(III)] tetra-hydrate.

Project description:In the binuclear centrosymmetric title compound, [In(2)(C(7)H(3)NO(4))(2)(C(7)H(4)NO(4))(2)(H(2)O)(2)]·4H(2)O, which contains both pyridine-2,3-dicarboxyl-ate and 3-carb-oxy-pyridine-2-carboxyl-ate ligands, the In(III) atom is six-coordinated in a distorted octa-hedral geometry. One pyridine ligand is N,O-chelated while the other is N,O-chelated and at the same time bridging to the other via the second carboxyl group. In the crystal, an extensive O-H?O hydrogen-bonding network, involving the coordinated and lattice water mol-ecules and the carboxyl groups of the ligands, together with C-H?O and ?-? inter-actions [centroid-centroid distance = 3.793?(1)?Å], leads to the formation of a three-dimensional structure.

| S-EPMC3254334 | biostudies-literature

Poly[?6-(naphthalene-2,6-di-carboxyl-ato)-bis-(aqua-lithium)].

Project description:The title compound, [Li2(C12H6O4)(H2O)2] n , crystallizes with one half of the molecular entities in the asymmetric unit. The second half is gererated by inversion symmetry. The crystal structure has a layered arrangement built from distorted edge-sharing LiO3(OH)2 tetra-hedra parallel to (100), with naphthalenedi-carboxyl-ate bridging the LiO3(OH)2 layers along the [100] direction. Hydrogen bonding between the water molecule and adjacent carboxylate groups consolidates the packing.

| S-EPMC4158488 | biostudies-literature

Di-?-hydroxido-bis-[aqua-(pyridine-2,6-dicarboxyl-ato)iron(III)] monohydrate.

Project description:In the dinuclear title complex, [Fe(2)(OH)(2)(C(7)H(3)NO(4))(2)(H(2)O)(2)]·H(2)O, the two Fe atoms are separated by 3.063?(1)?Å. Inter-molecular O-H?O hydrogen bonds form an extensive three-dimensional hydrogen-bonding network, which consolidates the crystal packing.

| S-EPMC3009288 | 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