Browse
Submit Data
Databases
API
Help

Dataset Information

22 Views

0 Connections

0 Citations

0 Reanalyses

0 Downloads

Omics score: 0

Chlorido{6,6'-dimethyl-2,2'-[1,2-phenyl-enebis(nitrilo-methyl-idyne)]diphenolato-κO,N,N',O'}manganese(III) mono-hydrate.

ABSTRACT: In the title complex, [Mn(C(22)H(18)N(2)O(2))Cl]·H(2)O, the Mn(III) center is in a distorted square-pyramidal configuration, with the N(2)O(2) dianionic tetra-dentate Schiff base ligand in the basal plane and the chloride ion in the apical position. The dihedral angle between the two outer phenolate rings of the tetra-dentate ligand is 8.25 (8)°. The central benzene ring makes dihedral angles of 4.31 (8) and 7.37 (8)° with the two outer phenolate rings. The water mol-ecule links to the complex via an O-H⋯Cl hydrogen bond. In addition, in the crystal structure, weak C-H⋯O inter-actions link the mol-ecules into infinite one-dimensional chains along [010]. The crystal is further stabilized by O-H⋯O and O-H⋯Cl hydrogen bonds, together with weak C-H⋯π inter-actions.

SUBMITTER: Eltayeb NE

PROVIDER: S-EPMC2960973 | biostudies-literature |

REPOSITORIES: biostudies-literature

ACCESS DATA

Json Xml

Similar Datasets

The cocrystal aqua-chlorido{6,6'-di-tert-butyl-2,2'-[1,2-phenyl-enebis(nitrilo-methyl-idyne)]diphenolato-κO,N,N',O'}-manganese(III)-chlorido{6,6'-di-tert-butyl-2,2'-[1,2-phenyl-enebis(nitrilo-methyl-idyne)]diphenolato-κO,N,N',O'}(methanol-κO)manganese(III) (1/1).

Project description:The asymmetric unit of the title complex, [Mn(C(28)H(30)N(2)O(2))Cl(H(2)O)][Mn(C(28)H(30)N(2)O(2))Cl(CH(3)OH)], contains two discrete Mn(III) complexes of a Schiff base ligand, with an N(2)O(2) donor set. Both Mn(III) centers are in a distorted octa-hedral geometry with the N(2)O(2) donor atoms of the tetra-dentate Schiff base dianion in the equatorial plane. The axial positions in the coordination environment of one Mn(III) complex are occupied by a chloride ion and a water mol-ecule, but a methanol mol-ecule replaces the water mol-ecule in the other complex. The coordinated water mol-ecule takes part in an O-H⋯Cl hydrogen bond between the two Mn(III) complexes. In the crystal structure, O-H⋯Cl hydrogen bonds link the mol-ecules into infinite one-dimensional chains along the [100] direction. The crystal structure is stabilized by O-H⋯Cl hydrogen bonds together with weak C-H⋯O and C-H⋯Cl inter-actions. A C-H⋯π inter-action is also observed in the crystal structure.

| S-EPMC2961111 | biostudies-literature

Chlorido{4,4'-dichloro-2,2'-[1,2-phenyl-enebis(nitrilo-methyl-idyne)]diphenolato-κO,N,N',O'}(methanol-κO)manganese(III).

Project description:In the title complex, [Mn(C(20)H(12)Cl(2)N(2)O(2))Cl(CH(3)OH)], the Mn(III) atom is in an octa-hedral coordination geometry with the N(2)O(2) atoms of the doubly-deprotonated Schiff base forming a square around it. The chloride ion and the O atom of the methanol mol-ecule occupy the other two positions of the octa-hedron. The dihedral angle between the two outer phenolate rings of the tetra-dentate ligand is 20.27 (12)°. The central phenyl-ene ring makes dihedral angles of 18.62 (12) and 6.02 (12)° with the two outer phenolate rings. Hydrogen bonds of the O-H⋯Cl type link the mol-ecules into an infinite chain along [010]. These chains are arranged into sheets parallel to the ab plane and these sheets are connected by weak C-H⋯Cl inter-actions into a three-dimensional network. The crystal structure is further stabilized by C-H⋯π inter-actions.

| S-EPMC2915075 | biostudies-literature

Chlorido{5,5'-dimethyl-2,2'-[1,2-phenyl-enebis(nitrilo-methyl-idyne)]diphenolato-κO,N,N',O'}manganese(III).

Project description:In the title complex, [Mn(C(22)H(18)N(2)O(2))Cl], the Mn(III) center is in a distorted square-pyramidal configuration; the basal plane is formed by the N(2)O(2) donors of the tetra-dentate Schiff base dianion, with the two phenol O atoms and two imine N atoms each mutually cis. The chloride ion occupies the apical coordination site. The dihedral angle between the two outer phenolate rings of the tetra-dentate ligand is 18.24 (9)°. The central benzene ring makes dihedral angles of 13.71 (8) and 30.50 (8)° with the two outer phenolate rings. In the crystal structure, weak C-H⋯Cl inter-actions link the mol-ecules into screw helices along the b direction. These helices are further connected by weak C-H⋯O inter-actions into a three-dimensional network. The crystal structure is further stabilized by C-H⋯π inter-actions involving the central benzene ring.

| S-EPMC2960927 | biostudies-literature

(Acetone-κO){6,6'-di-tert-butyl-2,2'-[1,2-phenyl-enebis(nitrilo-methyl-idyne)]diphenolato-κO,N,N',O'}zinc(II).

Project description:The mol-ecule of the title compound, [Zn(C(28)H(30)N(2)O(2))(CH(3)COCH(3))], lies across a mirror plane with the Zn(II) ion and the acetone mol-ecule on the mirror plane. The Zn(II) ion is in a five-coordinate distorted square-pyramidal N(2)O(3) environment, with the two imine N and two phenolic O atoms of the tetra-dentate Schiff base dianion in the basal plane and the acetone mol-ecule in the apical position. The central benzene ring makes a dihedral angle of 16.5 (2)° with the two outer phenolate rings. In the crystal structure, the mol-ecules are arranged into anti-parallel columns along the a axis.

| S-EPMC2961135 | biostudies-literature

{6,6'-Dieth-oxy-2,2'-[ethyl-enebis(nitrilo-methyl-idyne)]diphenolato}nickel(II) monohydrate.

Project description:In the title compound, [Ni(C(20)H(22)N(2)O(4))]·H(2)O, the Ni(II) ion and the water mol-ecule are located on a twofold rotation axis. The Ni ion is coordinated by two N [Ni-N = 1.8462 (18) Å] and two O [Ni-O = 1.8645 (14) Å] atoms in a distorted square-planar geometry. The water mol-ecule and the Ni complex mol-ecule are paired via O-H⋯O hydrogen bonds.

| S-EPMC2959910 | biostudies-literature

Chlorido{5,5'-dimeth-oxy-2,2'-[1,2-phenyl-enebis(nitrilo-methyl-idyne)]diphenolato-κO,N,N',O'}manganese(III).

Project description:In the title complex, [Mn(C(22)H(18)N(2)O(4))Cl], the Mn(III) centre is in a distorted square-pyramidal configuration, with the basal plane formed by the N(2)O(2) donors of the tetra-dentate Schiff base dianion; the two phenolate O atoms and the two imine N atoms are each mutually cis. The chloride ion occupies the apical position. The dihedral angle between the two outer phenolate rings of the tetra-dentate Schiff base ligand is 16.44 (9)°. The central benzene ring makes dihedral angles of 10.64 (9) and 25.17 (10)° with the two outer phenolate rings. In the crystal structure, weak C-H⋯O and C-H⋯Cl inter-actions link the mol-ecules into wave-like face-to-face double layers along the c direction. A π-π inter-action involving the two outer phenolate rings is observed, the centroid-centroid distance being 3.743 (11) Å.

| S-EPMC2961208 | biostudies-literature

{2,2'-[Ethyl-enebis(nitrilo-methyl-idyne)]diphenolato-κO,N,N',O'}oxido-vanadium(IV).

Project description:The title compound, [V(C(16)H(14)N(2)O(2))O], was synthesized by the reaction of vanadyl(IV) sulfate and N,N'-bis-(salicyl-idene)ethyl-enediamine under hydro-thermal conditions. The asymmetric unit contains two mol-ecules. Each V(IV) atom is coordinated in a square-pyramidal geometry by two N atoms and two O atoms from a ligand in the basal plane and by an oxide O atom in the apical position. Weak C-H⋯O hydrogen bonds lead to a three-dimensional supra-molecular structure.

| S-EPMC2961374 | biostudies-literature

{6,6'-Dieth-oxy-2,2'-[4,5-dimethyl-o-phenyl-enebis(nitrilo-methyl-idyne)]diphenolato}copper(II).

Project description:In the title complex, [Cu(C(26)H(26)N(2)O(4))], the Cu(II) ion lies on a crystallographic twofold rotation axis and is coordinated in a slightly distorted square-planar environment. The dihedral angle between the central benzene ring and each of the two symmetry-related outer benzene rings is 5.1?(2)°. The crystal structure is stabilized by inter-molecular ?-? inter-actions with centroid-centroid distances in the range 3.466?(2)-3.6431?(16)?Å.

| S-EPMC3009165 | biostudies-literature

{6,6'-Dimeth-oxy-2,2'-[4,5-dimethyl-o-phenyl-enebis(nitrilo-methyl-idyne)]diphenolato}nickel(II).

Project description:In the title Schiff base complex, [Ni(C(24)H(22)N(2)O(4))], the Ni(II) atom has a slightly distorted square-planar coordination environment. The dihedral angles between the central benzene ring and the two outer rings are 7.62?(16) and 9.78?(17)°. The crystal structure is stabilized by inter-molecular C-H?O hydrogen bonds and ?-? inter-actions with a centroid-centroid distance of 3.8218?(19)?Å.

| S-EPMC2983194 | biostudies-literature

Aqua-chlorido{6,6'-dimeth-oxy-2,2'-[ethane-1,2-diylbis(nitrilo-dimethyl-idyne)]diphenolato-κO,N,N',O}cobalt(III) monohydrate.

Project description:The title compound, [Co(C(18)H(18)N(2)O(4))Cl(H(2)O)]·H(2)O, contains a distorted octa-hedral cobalt(III) complex with a 6,6'-dimeth-oxy-2,2'-[ethane-1,2-diylbis(nitrilo-dimethyl-idyne)]diphenolate ligand, a chloride and an aqua ligand, and also a disordered water solvent mol-ecule (half-occupancy). The Co(III) ion is coordinated in an N(2)O(3)Cl manner. Weak O-H⋯O hydrogen bonds may help to stabilize the crystal packing.

| S-EPMC2968959 | biostudies-literature

OmicsDI is part of the ELIXIR infrastructure

OmicsDI is an Elixir interoperability service. Learn more ›

Tweets

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