Browse
Submit Data
Databases
API
Help

Dataset Information

12 Views

0 Connections

0 Citations

0 Reanalyses

0 Downloads

Omics score: 0

Cis-Dichloridobis(1,10-phenanthroline-?N,N')manganese(II)-2,6-dihydroxy-benzoic acid-water (2/1/4).

ABSTRACT: In the crystal structure of the title compound, [MnCl(2)(C(12)H(8)N(2))(2)]·0.5C(7)H(6)O(4)·2H(2)O, the Mn(II) complex assumes a distorted octa-hedral geometry formed by two chloride anions and two phenanthroline (phen) ligands. The 2,6-dihydroxy-benzoic acid mol-ecule is disordered about an inversion center. The face-to-face separations of 3.540?(11) and 3.429?(8)?Å between parallel phen ligands indicate the existence of ?-? stacking between adjacent Mn(II) complexes. Uncoordinated water mol-ecules are linked with complex and dihydroxy-benzoic acid mol-ecules via O-H?Cl and O-H?O hydrogen bonds.

SUBMITTER: Yang Q

PROVIDER: S-EPMC2961560 | biostudies-literature | 2008 May

REPOSITORIES: biostudies-literature

ACCESS DATA

Json Xml

Publications

cis-Dichloridobis(1,10-phenanthroline-κN,N')manganese(II)-2,6-dihydroxy-benzoic acid-water (2/1/4).

Yang Qian Q Nie Jing-Jing JJ Xu Duan-Jun DJ

Acta crystallographica. Section E, Structure reports online 20080503 Pt 6

In the crystal structure of the title compound, [MnCl(2)(C(12)H(8)N(2))(2)]·0.5C(7)H(6)O(4)·2H(2)O, the Mn(II) complex assumes a distorted octa-hedral geometry formed by two chloride anions and two phenanthroline (phen) ligands. The 2,6-dihydroxy-benzoic acid mol-ecule is disordered about an inversion center. The face-to-face separations of 3.540 (11) and 3.429 (8) Å between parallel phen ligands indicate the existence of π-π stacking between adjacent Mn(II) complexes. Uncoordinated water mol-ec ...[more]

PMID: 21202450

Similar Datasets

cis-Dichloridobis(1,10-phenanthroline)chromium(III) chloride.

Project description:In the title complex, [CrCl(2)(C(12)H(8)N(2))(2)]Cl, the Cr(III) ion is situated on a twofold rotation axis and displays a slightly distorted octa-hedral CrCl(2)N(4) coordination geometry. The Cr environment is composed of a cis arrangement of two 1,10-phenanthroline and two chloride ligands. The chloride counter-anion exhibits half-occupation and is equally disordered over two positions.

| S-EPMC3051699 | biostudies-literature

cis-Dichloridobis(1,10-phenanthroline)cobalt(II) dimethyl-formamide solvate.

Project description:In the title complex, [CoCl(2)(C(12)H(8)N(2))(2)]·C(3)H(7)NO, which has twofold rotation symmetry, the Co(II) cation is coordinated by two 1,10-phenanthroline (phen) mol-ecules and two chloride ligands in a distorted octa-hedral geometry. In the crystal structure, a cavity is created by six complex mol-ecules connected by C-H?? inter-actions and non-classical C-H?Cl hydrogen bonds. The cavities are occupied by the disordered dimethyl-formamide solvent mol-ecule. The C and N atoms of the C-N bond in the solvent mol-ecule also lie on a crystallographic twofold rotation axis; the remaining atoms of the solvent are statistically disordered (ratio 0.5:0.5) about this axis.

| S-EPMC2959430 | biostudies-other

Dichloridobis(1,10-phenanthroline-5,6-dione-κN,N')mercury(II).

Project description:In the title compound, [HgCl(2)(C(12)H(6)N(2)O(2))(2)], the Hg(II) atom is located on a twofold rotation axis and exists within a distorted octa-hedral geometry defined by a cis-Cl(2)N(4) donor set. Mol-ecules are connected into layers in the ac plane via extensive C-H⋯Cl contacts as each Cl atom forms two such inter-actions. Contacts between the layers are of the type C=O⋯π [O⋯centroid distance = 3.110 (8) Å].

| S-EPMC2971919 | biostudies-literature

Dichlorido(2,9-dimethyl-1,10-phenanthroline)manganese(II) hemihydrate.

Project description:In the title compound, [MnCl(2)(C(14)H(12)N(2))]·0.5H(2)O, all of the non-H atoms apart from the Cl atom lie on a mirror plane and the methyl H atoms are disordered over two sites of equal occupancy about the mirror plane. The Mn(II) ion is coordinated in a distorted tetra-hedral environment by two N atoms of the phenanthroline ligand and two chloride ions. A half-occupancy solvent water mol-ecule lies on a mirror plane and close to an inversion center.

| S-EPMC2971941 | biostudies-literature

Aqua-(2,9-dimethyl-1,10-phenanthroline-?N,N')bis-(3-hydroxy-benzoato-?O)manganese(II)-2,9-dimethyl-1,10-phenanthroline-water (1/1/1).

Project description:In the title compound, [Mn(C(7)H(5)O(3))(2)(C(14)H(12)N(2))(H(2)O)]·C(14)H(12)N(2)·H(2)O, the Mn(II) ion is coordinated by a bidentate 2,9-dimethyl-1,10-phenanthroline (dmphen) ligand, two monodentate 3-hydroxy-benzoate anions (3-HBA) and one water mol-ecule in a distorted trigonal-bipyramidal environment. An uncoordinated dmphen and an uncoordinated water mol-ecule cocrystallized with each complex mol-ecule. Intra- and inter-molecular O-H?N and O-H?O hydrogen bonds are also present between the coordinated 3-HBA and water mol-ecules and the uncoordinated dmphen and water mol-ecules in the crystal. The packing of the structure is further stabilized by ?-? stacking inter-actions involving dmphen mol-ecules, with a centroid-centroid separation of 3.705?(3)?Å.

| S-EPMC2977455 | biostudies-literature

Dichloridobis(2-dimethyl-amino-1,10-phenanthroline)cadmium(II).

Project description:In the title complex, [CdCl(2)(C(14)H(13)N(3))(2)], the Cd(II) ion lies on a twofold rotation axis and assumes a distorted octa-hedral CdN(4)Cl(2) coordination geometry. There is a ?-? stacking inter-action between the symmetry-related 1,10-phenanthroline ligands with a centroid-centroid distance of 3.5578?(16)?Å and a perpendicular distance of 3.445?(su?)?Å between the relevant rings.

| S-EPMC2969892 | biostudies-other

cis-Dichloridobis-(5,5'-dimethyl-2,2'-bipyridine)-manganese(II) 2.5-hydrate.

Project description:The metal site in the title compound [MnCl(2)(C(12)H(12)N(2))(2)]·2.5H(2)O has a distorted octa-hedral geometry, coordinated by four N atoms of two 5,5'-dimethyl-2,2'-dipyridine ligands and two Cl atoms. Two and a half water molecules of hydration per complex unit are observed in the crystal structure. The compounds extend along the c axis with O-H?Cl, O-H?O, C-H?Cl and C-H?O hydrogen bonds and ?-? inter-actions [centroid-centroid distance = 3.70?(2)?Å] contributing substanti-ally to the crystal packing. The Mn and one of the water O atoms, the latter being half-occupied, are located on special positions, in this case a rotation axis of order 2.

| S-EPMC3152002 | biostudies-literature

catena-Poly[[(1,10-phenanthroline)manganese(II)]-?(3)-5-methyl-isophthalato].

Project description:In the title coupound, [Mn(C(9)H(6)O(4))(C(12)H(8)N(2))](n), the Mn(II) ion is coordinated by two N atoms [Mn-N = 2.273?(3) and 2.305?(2)?Å] from a 1,10-phenanthroline ligand and four O atoms [Mn-O = 2.112?(2)-2.343?(3)?Å] from three 5-methyl-isophthalate (mip) ligands in a distorted octa-hedral geometry. Each mip dianion acts as a tetra-dentate ligand connecting three Mn ions. The crystal packing exhibits ?-? inter-actions [3.599?(2)-3.755?(2)?Å] between the centroids of the six-membered rings of neighbouring 1,10-phenanthroline ligands.

| S-EPMC2960010 | biostudies-literature

Bis(?-4-nitro-phthalato)bis-[diaqua-(1,10-phenanthroline)manganese(II)].

Project description:In the title compound, [Mn(2)(C(8)H(3)NO(6))(2)(C(12)H(8)N(2))(2)(H(2)O)(4)], the Mn(II) atom in the centrosymmetric binuclear unit has a distorted octa-hedral geometry and is coordinated by a chelating 1,10-phenanthroline ligand, two monodentate carboxyl-ate anions from two 4-nitro-phthalates and two coordinated water mol-ecules. The two Mn(II) ions in the mol-ecule are bridged by two 4-nitro-phthalate anions, both in a bis-monodentate mode, which finally leads to the formation of the binuclear unit. Intra-molecular O-H?O hydrogen bonds between the coordinated and uncoordinated O atoms of one monodentate carboxyl-ate group and the corresponding coordinated water mol-ecules result in an eight-membered and two six-membered rings. In the crystal structure, inter-molecular O-H?O hydrogen bonds link the dinuclear mol-ecules into supra-molecular chains propagating parallel to [100].

| S-EPMC2977488 | biostudies-literature

Aqua-(2,9-dimethyl-1,10-phenanthroline-?N,N')bis-(2-hydroxy-benzoato-?O)manganese(II) 2,9-dimethyl-1,10-phenanthroline hemisolvate.

Project description:In the asymmetric unit of the title complex, [Mn(C(7)H(5)O(3))(2)(C(14)H(12)N(2))(H(2)O)]·0.5C(14)H(12)N(2), the Mn(II) ion is coordinated by a bidentate 2,9-dimethyl-1,10-phenanthroline (dmphen) mol-ecule, one water mol-ecule and two monodentate 2-hydroxy-benzoate anions in a distorted trigonal-bipyramidal geometry. The OH group of the 2-hydroxy-benzoate anion is disordered over two positions with site-occupancy factors of 0.5. The asymmetric unit is completed with by an uncoordinated half-mol-ecule of dmphen, disordered about a crystallographic twofold axis. In the crystal structure, mol-ecules are linked into a two-dimensional framework by O-H?N, O-H?O and C-H?O hydrogen bonds. The packing of the structure is further stabilized by ?-? stacking inter-actions involving dmphen mol-ecules, with centroid-centroid separations of 3.8027?(3) and 3.6319?(3)?Å.

| S-EPMC2968132 | 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