Browse
Submit Data
Databases
API
Help

Dataset Information

23 Views

0 Connections

0 Citations

0 Reanalyses

0 Downloads

Omics score: 0

Poly[?(2)-aqua-?(4)-naphthalene-1,8-dicarboxyl-ato-manganese(II)].

ABSTRACT: The asymmetric unit of the title complex, [Mn(C(12)H(6)O(4))(H(2)O)](n), contains one Mn(II) ion, one 1,8-naphthalene-dicarboxyl-ate (1,8-NDC) ligand and one water mol-ecule. The Mn(II) ion is six-coordinated within a distorted octa-hedral coordination geometry, in which the equatorial sites are occupied by four carboxyl-ate O atoms from four different 1,8-NDC ligands, while the axial positions are occupied by two O atoms of two coordinated water mol-ecules. Adjacent Mn(II) centres are bridged by one coordinated water and two carboxyl-ate groups in a syn-syn mode to form infinite chains along the b axis, which are further cross-linked by the naphthalene spacers of the 1,8-NDC ligands to produce a two-dimensional extended network.

SUBMITTER: Zhang GY

PROVIDER: S-EPMC2915142 | biostudies-literature | 2007 Dec

REPOSITORIES: biostudies-literature

ACCESS DATA

Json Xml

Publications

Poly[μ(2)-aqua-μ(4)-naphthalene-1,8-dicarboxyl-ato-manganese(II)].

Zhang Guo-Ying GY Zhang Xin X Yu Gui-Sheng GS

Acta crystallographica. Section E, Structure reports online 20071218 Pt 1

The asymmetric unit of the title complex, [Mn(C(12)H(6)O(4))(H(2)O)](n), contains one Mn(II) ion, one 1,8-naphthalene-dicarboxyl-ate (1,8-NDC) ligand and one water mol-ecule. The Mn(II) ion is six-coordinated within a distorted octa-hedral coordination geometry, in which the equatorial sites are occupied by four carboxyl-ate O atoms from four different 1,8-NDC ligands, while the axial positions are occupied by two O atoms of two coordinated water mol-ecules. Adjacent Mn(II) centres are bridged b ...[more]

PMID: 21200561

Similar Datasets

Poly[?-aqua-aqua-?4-naphthalene-1,8-dicarboxyl-ato-barium]: a layer structure.

Project description:The title compound, [Ba(C12H6O4)(H2O)2] n , is represented by a layer-like structure built of BaO8 polyhedra. The asymmetric unit contains a Ba(2+) ion, half a coordinating water mol-ecule and half a ?4-bridging naphthalene-1,8-dicarboxyl-ate (1,8-nap) ligand, the whole structure being generated by twofold rotational symmetry. The carboxyl-ate groups of the 1,8-nap ligands act as bridges linking four Ba(2+) ions, while each Ba(2+) ion is eight-coordinated by O atoms from four 1,8-nap ligands and two coordinating water mol-ecules. In the crystal, there are O-H?O hydrogen bonds involving the water mol-ecules and carboxyl-ate O atoms in the BaO8 polyhedra. Each BaO8 polyhedron is connected via corner-sharing water O atoms or edge-sharing ligand O atoms, forming a sheet parallel to the bc plane. These sheets stack along the a-axis direction and are connected via van der Waals forces only. The naphthalene groups protrude above and below the layers of the BaO8 polyhedra and there are voids of ca 208?Å(3) bounded by these groups. No residual electron density was found in this region. The crystal studied was twinned by pseudo-merohedry, with a refined twin component ratio of 0.5261?(1):0.4739?(1).

| S-EPMC3629495 | biostudies-literature

Bis(?-naphthalene-1,8-dicarboxyl-ato)bis-[aqua-(2,2'-bipyridine)zinc(II)] tetra-hydrate.

Project description:The title complex, [Zn(2)(C(12)H(6)O(4))(2)(C(10)H(8)N(2))(2)(H(2)O)(2)]·4H(2)O, is a binuclear complex with two independent Zn(II) ions in a slightly disorted trigonal bipyramidal environment, coordinated by one aqua ligand, two naphthalene-1,8-dicarboxyl-ate ligands and one 2,2'-bipyridine ligand. ?-? Inter-actions [centroid-centroid distance of 3.8489?(5)?Å] and O-H?O hydrogen bonds connect the mol-ecules, forming a three-dimensional structure.

| S-EPMC2959877 | biostudies-literature

Poly[(μ-4,4'-bipyridine)(μ-naphthalene-1,4-dicarboxyl-ato)manganese(II)].

Project description:In the crystal structure of the title compound, [Mn(C(12)H(6)O(4))(C(10)H(8)N(2))](n), the Mn atoms are each coordinated by four O atoms of naphthalene-1,4-dicarboxyl-ate anions and two N atoms of two symmetry-related 4,4'-bipyridine ligands within a strongly distorted octa-hedra. Two of the O atoms originate from one naphthalene-1,4-dicarboxyl-ate anion, whereas the remaining two O atoms derive from two symmetry-equivalent naphthalene-1,4-dicarboxyl-ate anions. Two Mn atoms are connected via the anions into dimers, which are further linked by the anions and the N-donor ligands into a three-dimensional coordination network.

| S-EPMC2968939 | biostudies-literature

Poly[?(2)-aqua-aqua-(?(3)-1H-benzimidazole-5,6-dicarboxyl-ato-?N:O:O)manganese(II)].

Project description:In the title complex, [Mn(C(9)H(4)N(2)O(4))(H(2)O)(2)](n), the Mn(II) atom is in a distorted octa-hedral coordination completed by one N atom from one 1H-benzimidazole-5,6-dicarboxyl-ate ligand, two O atoms from two different 1H-benzimidazole-5,6-dicarboxyl-ate ligands, and three O atoms from three water mol-ecules. Two bridging water mol-ecules and two bridging carboxyl-ate groups from a 1H-benzimidazole-5,6-dicarboxyl-ate ligand connect two Mn(II) ions into a dimeric structure. In the crystal, extensive inter-molecular O-H?O, N-H?O and C-H?O hydrogen bonding forms a three-dimensional network.

| S-EPMC2979272 | biostudies-literature

cyclo-Tetra-kis(?-naphthalene-1,8-dicarboxyl-ato)tetra-kis-[diaqua-(2,2'-bipyridine)-manganese(II)] tetra-hydrate.

Project description:In the title centrosymmetric tetra-nuclear complex, [Mn(4)(C(12)H(6)O(4))(4)(C(10)H(8)N(2))(4)(H(2)O)(8)]·4H(2)O, two independent Mn(II) ions are coordinated in a slightly disorted octa-hedral environment by two aqua ligands, two naphthalene-1,8-dicarboxyl-ate (1,8-nap) ligands and one bis-chelating 2,2'-bipyridine (2,2'-bipy) ligand. In the crystal, mol-ecules are linked by inter-molecular O-H?O hydrogen bonds into chains along [100]. These chains are further linked by weak ?-? inter-actions with centroid-centroid distances in the range of 3.609?(2)-3.758?(1)?Å, forming a three-dimensional supra-molecular network.

| S-EPMC3011697 | biostudies-literature

Bis(?-naphthalene-1,8-dicarboxyl-ato-?O:O)bis-[aqua-bis-(N,N'-dimethyl-formamide-?O)copper(II)].

Project description:In the centrosymmetric dinuclear title complex, [Cu(2)(C(12)H(6)O(4))(2)(C(3)H(7)NO)(4)(H(2)O)(2)], the coordination environment of each Cu(II) atom displays a distorted CuO(5) square-pyramidal geometry, which is formed by two carboxyl-ate O atoms of two ?-1,8-nap ligands (1,8-nap is naphthalene-1,8-dicarboxyl-ate), two O atoms of two DMF (DMF is N,N'-dimethyl-formamide) and one coordinated water mol-ecule. The Cu-O distances involving the four O atoms in the square plane are in the range 1.9501?(11)-1.9677?(11)?Å, with the Cu atom lying nearly in the plane [deviation = 0.0726?(2)?Å]. The axial O atom occupies the peak position with a Cu-O distance of 2.885?(12)?Å, which is significantly longer than the rest of the Cu-O distances. Each 1,8-nap ligand acts as bridge, linking two Cu(II) atoms into a dinuclear structure. Inter-molecular O-H?O and C-H?O hydrogen-bonding inter-actions consolidate the structure.

| S-EPMC3007367 | biostudies-literature

catena-Poly[[[aqua-(1,10-phenanthro-line)manganese(II)]-μ-adamantane-1,3-dicarboxyl-ato] monohydrate].

Project description:In the title coordination polymer, {[Mn(C(12)H(14)O(4))(C(12)H(8)N(2))(H(2)O)]·H(2)O}(n), the Mn(II) atom has a highly distorted cis-MnN(2)O(4) octa-hedral geometry arising from its coordination by a bidentate phenanthroline ligand, a water mol-ecule and monodentate and bidentate adamantane-1,3-dicarboxyl-ate dianions. The bridging dianion leads to [001] chains in the crystal. The chains are linked by O-H⋯O hydrogen bonds, involving both the coordinated and uncoordinated water mol-ecules, thereby forming a two-dimensional network.

| S-EPMC3246965 | biostudies-literature

Poly[?-aqua-[?-1,1'-(butane-1,4-di-yl)diimidazole]bis-(?(4)-naphthalene-1,4-dicarboxyl-ato)dicadmium(II)].

Project description:In the title compound, [Cd(2)(C(12)H(6)O(4))(2)(C(10)H(14)N(4))(H(2)O)](n), the coordination polyhedron around each Cd(II) ion is a distorted CdNO(5) octa-hedron. The water O atom has site symmetry 2 and the complete 1,1'-(butane-1,4-di-yl)diimidazole (L) ligand is generated by inversion. The naphthalene-1,4-dicarboxyl-ate and L ligands bridge the metal centres, forming a three-dimensional framework, which is consolidated by O-H?O hydrogen bonds.

| S-EPMC2960000 | biostudies-literature

Poly[aqua-[?(2)-1,1'-(butane-1,4-di-yl)diimidazole](?(2)-naphthalene-1,4-dicarboxyl-ato)nickel(II)].

Project description:In the title compound, [Ni(C(12)H(6)O(4))(C(10)H(14)N(4))(H(2)O)](n), the coordination polyhedron around each Ni(II) atom is a distorted cis-NiN(2)O(4) octa-hedron. The naphthalene-1,4-dicarboxyl-ate and 1,1'-(butane-1,4-di-yl)diimidazole ligands bridge the Ni centres to form a two-dimensional (4,4)-network, and O-H?O hydrogen bonds complete the structure.

| S-EPMC2960619 | biostudies-literature

catena-Poly[[[aqua-bis(1H-imidazole-?N)copper(II)]-?-naphthalene-1,4-dicarboxyl-ato-?O:O] dihydrate].

Project description:In the title compound, {[Cu(C(12)H(6)O(4))(C(3)H(4)N(2))(2)(H(2)O)]·2H(2)O}(n), the Cu(II) cation is coordinated by two naphthalene-1,4-dicarboxyl-ate (naph) dianions, two imidazole mol-ecules and one water mol-ecule in a distorted square-pyramidal geometry. The Cu-O bond distance in the apical direction is 0.509?(3)?Å longer than the mean Cu-O bond distance in the basal plane. The naph dianion bridges two Cu(II) cations, forming a one-dimensional polymeric chain. The coordinated water mol-ecule is hydrogen-bonded to the carboxylate groups and imidazole ligands of adjacent polymeric chains, forming a three-dimensional supra-molecular structure. No ?-? stacking is observed in the crystal structure. One solvent water molecule is disordered equally over two positions.

| S-EPMC2961746 | 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