Browse
Submit Data
Databases
API
Help

Dataset Information

17 Views

0 Connections

0 Citations

0 Reanalyses

0 Downloads

Omics score: 0

Poly[[(?-3-amino-pyrazine-2-carboxyl-ato-?N,O:O')diaqua-(?-oxalato-?O,O:O,O)lanthanum(III)] monohydrate].

ABSTRACT: The water-coordinated La(III) atom in the title compound, {[La(C(5)H(4)N(3)O(2))(C(2)O(4))(H(2)O)(2)]·H(2)O}(n), is N,O-chelated by a 3-amino-pyrazine-2-carboxyl-ate ion; this ion links adjacent metal atoms to form a chain parallel to [010]. The oxalate ion serves as a bis-bidentate chelate that links adjacent metal atoms to form a chain parallel to [001]. The two bridging ions give rise to a layer motif parallel to (100) in which the La(III) atom exists in a distorted tricapped trigonal prismatic geometry. Extensive hydrogen bonding between the constituents stabilizes the structure.

SUBMITTER: Gao S

PROVIDER: S-EPMC3200678 | biostudies-literature | 2011 Sep

REPOSITORIES: biostudies-literature

ACCESS DATA

Json Xml

Publications

Poly[[(μ-3-amino-pyrazine-2-carboxyl-ato-κN,O:O')diaqua-(μ-oxalato-κO,O:O,O)lanthanum(III)] monohydrate].

Gao Shan S Ng Seik Weng SW

Acta crystallographica. Section E, Structure reports online 20110827 Pt 9

The water-coordinated La(III) atom in the title compound, {[La(C(5)H(4)N(3)O(2))(C(2)O(4))(H(2)O)(2)]·H(2)O}(n), is N,O-chelated by a 3-amino-pyrazine-2-carboxyl-ate ion; this ion links adjacent metal atoms to form a chain parallel to [010]. The oxalate ion serves as a bis-bidentate chelate that links adjacent metal atoms to form a chain parallel to [001]. The two bridging ions give rise to a layer motif parallel to (100) in which the La(III) atom exists in a distorted tricapped trigonal prismat ...[more]

PMID: 22058888

Similar Datasets

Poly[diaqua-μ-oxalato-μ-pyrazine-2-carbox-yl-ato-lanthanum(III)].

Project description:In the title complex, [La(C(5)H(3)N(2)O(2))(C(2)O(4))(H(2)O)(2)](n), the La(III) ion is coordinated by one N and three O atoms from two pyrazine-2-carboxylate ligands, by four O atoms from two oxalate ligands and by two O atoms of two water molecules, displaying a distorted bicapped square-anti-prismatic geometry. The carboxyl-ate groups of pyrazine-2-carboxyl-ate and oxalate ligands link the lanthanum metal centres, forming layers parallel to (10). The layers are further connected by inter-molecular O-H⋯O and N-H⋯O hydrogen-bonding inter-actions, forming a three-dimensional supra-molecular network.

| S-EPMC2967913 | biostudies-literature

Poly[diaqua-(?-oxalato)(?-2-oxidopyridinium-3-carboxyl-ato)lanthanum(III)].

Project description:In the title complex, [La(C(6)H(4)NO(3))(C(2)O(4))(H(2)O)(2)](n), the La(III) ion is coordinated by eight O atoms from two 2-oxido-pyridinium-3-carboxyl-ate ligands, two oxalate ligands and two water mol-ecules in a distorted bicapped square-anti-prismatic geometry. The carboxyl-ate groups link adjacent La(III) ions, forming two-dimensional layers that are further linked by N-H?O and O-H?O hydrogen bonds.

| S-EPMC2969809 | biostudies-other

catena-Poly[[[bis-(3-amino-pyrazine-2-carboxyl-ato)triaqua-praseodymium(III)]-μ-3-amino-pyrazine-2-carboxyl-ato-[(3-amino-pyrazine-2-carboxyl-ato)diaqua-formatopraseodymium(III)]-μ-3-amino-pyrazine-2-carboxyl-ato] hexa-hydrate].

Project description:The asymmetric unit of the polymeric title compound, {[Pr(2)(C(5)H(4)N(3)O(2))(5)(CHO(2))(H(2)O)(5)]·6H(2)O}(n), has two independent Pr(III) atoms; one is coordinated by two water mol-ecules and the other by three water mol-ecules. The first is N,O-chelated by three 3-amino-pyrazine-2-carboxyl-ate ions, whereas the second is chelated by two carboxyl-ate ions; both exist in a monocapped square-anti-prismatic geometry. The polymeric chains that run along the a axis inter-act with the lattice water mol-ecules, generating a three-dimensional hydrogen-bonded network. The formate ion is disordered over two positions with respect to the non-coordinated atoms in a 1:1 ratio.

| S-EPMC3200950 | biostudies-literature

Poly[[hemi-?(4)-oxalato-hemi-?(2)-oxalato-bis-(?(3)-pyrazine-2-carboxyl-ato)erbium(III)silver(I)] monohydrate].

Project description:The asymmetric unit of the title complex, {[AgEr(C(5)H(3)N(2)O(2))(2)(C(2)O(4))]·H(2)O}(n), contains one Er(III) atom, one Ag(I) atom, two pyrazine-2-carboxyl-ate (pyc) ligands, two half oxalate ligands (each lying on an inversion center) and one uncoordinated water mol-ecule. The Er(III) atom is coordinated by two O atoms and two N atoms from two pyc ligands, one O atom from a third pyc ligand and four O atoms from two oxalate ligands in a distorted monocapped square-anti-prismatic geometry. The Ag(I) atom is coordinated by two N atoms from two pyc ligands, one O atom from a third pyc ligand and one O atom from one oxalate ligand. The crystal structure exhibits a three-dimensional heterometallic polymeric network. O-H?O hydrogen bonding between the uncoordinated water mol-ecule and carboxyl-ate O atoms is observed.

| S-EPMC2977120 | biostudies-literature

Poly[[hemi-?(4)-oxalato-hemi-?(2)-oxalato-bis-(?(3)-pyrazine-2-carboxyl-ato)neodymium(III)silver(I)] monohydrate].

Project description:In the title coordination polymer, {[AgNd(C(5)H(3)N(2)O(2))(2)(C(2)O(4))]·H(2)O}(n), the Nd(III) atom is coordinated in a distorted monocapped square-anti-prismatic geometry by two O and two N atoms of two N,O-bidentate pyrazine-2-carboxyl-ate (2-pzc) ligands, four O atoms of two bidentate oxalate ligands, and one O atom of a monodentate carboxyl-ate group of a 2-pzc ligand. The Ag(I) ion is coordinated in a distorted tetra-hedral geometry by two N atoms from two monodentate 2-pzc ligands, one O atom from one monodentate oxalate ligand and one O atom of a bridging carboxyl-ate group of a 2-pzc ligand. The oxalate anions link neighbouring neodymium(III) metal centres into Nd-oxalate chains, which are inter-connected by Ag(2-pyz)(2) units, forming a three-dimensional polymeric framework. Inter-molecular O-H?O and C-H?O hydrogen bonds are observed in the crystal structure.

| S-EPMC2969187 | biostudies-literature

Poly[diaqua-(?-oxalato)(?-2-oxido-pyridinium-3-carboxyl-ato)praseo-dymium(III)].

Project description:In the title complex, [Pr(C(6)H(4)NO(3))(C(2)O(4))(H(2)O)(2)](n), each Pr(III) ion is coordinated by eight O atoms from two 2-oxynicotinate ligands, two oxalate ligands and two water mol-ecules, displaying a distorted bicapped square-anti-prismatic geometry. The carboxyl-ate groups link adjacent praseodymium metal centres, forming layers parallel to the bc plane. The crystal packing is stabilized by inter-molecular O-H?O and N-H?O hydrogen bonds.

| S-EPMC2968694 | biostudies-literature

Poly[diaqua-(μ(2)-oxalato-κO,O:O,O)(μ(2)-pyrazine-2-carboxyl-ato-κN,O:O,O')neodymium(III)].

Project description:In the title complex, [Nd(C(5)H(3)N(2)O(2))(C(2)O(4))(H(2)O)(2)](n), the Nd(III) atom is ten-coordinated by one N atom and three O atoms from two pyrazine-2-carboxyl-ate ligands, four O atoms from two oxalate ligands and two water mol-ecules in a distorted bicapped square-anti-prismatic geometry. The two crystallographically independent oxalate ligands, each lying on an inversion center, act as bridging ligands, linking Nd atoms into an extended zigzag chain. Neighboring chains are linked by the pyrazine-2-carboxyl-ate ligands into a two-dimensional layerlike network in the (10) plane. The layers are further connected by O-H⋯O and O-H⋯N hydrogen bonds, forming a three-dimensional supra-molecular network.

| S-EPMC2969933 | biostudies-literature

catena-Poly[[[diaqua-nickel(II)]-?-pyrazine-2-carboxyl-ato-silver(I)-?-pyrazine-2-carboxyl-ato] nitrate dihydrate].

Project description:In the polymeric complex of the title compound, {[AgNi(C(5)H(3)N(2)O(2))(2)(H(2)O)(2)]NO(3)·2H(2)O}(n), the Ag(I) ion displays an angular coordination geometry with two N atoms from pyrazine-2-carboxyl-ate ligands, and the Ni(II) ion is hexa-coordinated by two O atoms from two water mol-ecules, two O and two N atoms from pyrazine-2-carboxyl-ate ligands in a distorted octa-hedral geometry. In the crystal, the Ag(I) and Ni(II) ions lie on a mirror plane and an inversion centre, respectively. The complex chains, the nitrate ions and the uncoordinated water mol-ecules are linked together through O-H?O hydrogen bonds and weak Ag?O inter-actions [2.619?(17)-2.749?(17)?Å] into a three-dimensional network.

| S-EPMC3344408 | biostudies-literature

Tris(3-amino-pyrazine-2-carboxyl-ato-?N,O)diaqua-erbium(III) tetra-hydrate.

Project description:The water-coordinated Er(III) atom in the title compound, [Er(C(5)H(4)N(3)O(2))(3)(H(2)O)(2)]·4H(2)O, is N,O-chelated by three 3-amino-pyrazine-2-carboxyl-ate ions and has a square-anti-prismatic geometry. The mononuclear mol-ecule inter-acts with the solvent water mol-ecules to generate a three-dimensional hydrogen-bonded network.

| S-EPMC3200703 | biostudies-literature

Poly[diaqua(?(2)-oxalato-?O,O:O,O)(?(2)-pyrazine-2-carboxyl-ato-?N,O:O')cerium(III)].

Project description:In the hydro-thermally synthesized title compound, [Ce(C(5)H(3)N(2)O(2))(C(2)O(4))(H(2)O)(2)](n), the Ce(III) ion is coordinated by four O atoms from two different oxalate ligands, three O atoms from two symmetry-related pyrazine-2-carboxyl-ate ligands, two O atoms from two water melecules and one N atom from a pyrazine-2-carboxyl-ate ligand in a distorted bicapped square-anti-prismatic coordination geometry. The oxalate and pyrazine-2-carboxyl-ate ligands bridge the Ce(III) ions, forming a two-dimensional structure. In addition, inter-molecular O-H?O and O-H?N hydrogen bonds connect the two-dimensional structure into a three-dimensional network.

| S-EPMC2959293 | biostudies-other

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