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Bis(?-2-carboxymethyl-2-hydroxy-butane-dioato)bis-[diaqua-manganese(II)]-1,2-bis-(pyridin-4-yl)ethane-water (1/1/2).

ABSTRACT: The asymmetric unit of the title compound, [Mn(2)(C(6)H(6)O(7))(2)(H(2)O)(4)]·C(12)H(12)N(2)·2H(2)O, comprises half of a centrosymmetric dimer, half of a 1,2-bis-(pyridin-4-yl)ethane and one water mol-ecule. Two citrate ligands bridge two Mn(II) ions, the Mn(II) ion being coordinated by four O atoms from the citrate(2-) ligands and two water O atoms, forming a distorted octa-hedral environment. In the crystal, O-H?O hydrogen bonds link the centrosymmetric dimers and lattice water mol-ecules into a three-dimensional structure which is further stabilized by inter-molecular ?-? inter-actions [centroid-centroid distance = 3.792?(2)?Å].

SUBMITTER: Hwang IH

PROVIDER: S-EPMC3414161 | biostudies-literature | 2012 Aug

REPOSITORIES: biostudies-literature

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Bis(μ-2-carboxymethyl-2-hydroxy-butane-dioato)bis-[diaqua-manganese(II)]-1,2-bis-(pyridin-4-yl)ethane-water (1/1/2).

Hwang In Hong IH Kim Pan-Gi PG Kim Cheal C Kim Youngmee Y

Acta crystallographica. Section E, Structure reports online 20120725 Pt 8

The asymmetric unit of the title compound, [Mn(2)(C(6)H(6)O(7))(2)(H(2)O)(4)]·C(12)H(12)N(2)·2H(2)O, comprises half of a centrosymmetric dimer, half of a 1,2-bis-(pyridin-4-yl)ethane and one water mol-ecule. Two citrate ligands bridge two Mn(II) ions, the Mn(II) ion being coordinated by four O atoms from the citrate(2-) ligands and two water O atoms, forming a distorted octa-hedral environment. In the crystal, O-H⋯O hydrogen bonds link the centrosymmetric dimers and lattice water mol-ecules into ...[more]

PMID: 22904768

Similar Datasets

Bis(?-2-carb-oxy-methyl-2-hy-droxy-butane-dioato)bis-[diaqua-manganese(II)]-1,2-bis-(pyridin-4-yl)ethene-water (1/1/2).

Project description:The asymmetric unit of the title compound, [Mn2(C6H6O7)2(H2O)4]·C12H10N2·2H2O, contains half of the centrosymmetric Mn complex dimer, half of a 1,2-bis-(pyridin-4-yl)ethene mol-ecule, which lies across an inversion center, and one water mol-ecule. Two citrate ligands bridge two Mn(II) ions, and each Mn(II) atom is coordinated by four O atoms from the citrate ligands (one from hy-droxy and three from carboxyl-ate groups) and two water O atoms, forming a distorted octa-hedral environment. In the crystal, O-H?O and O-H?N hydrogen bonds link the centrosymmetric dimers and lattice water mol-ecules into a three-dimensional structure which is further stabilized by inter-molecular ?-? inter-actions [centroid-centroid distance = 3.959?(2)?Å]. Weak C-H?O hydrogen bonding interactions are also observed.

| S-EPMC3588763 | biostudies-literature

catena-Poly[[[bis-(methanol-κO)bis-(seleno-cyanato-κN)manganese(II)]-μ-1,2-bis-(pyridin-4-yl)ethane-κ(2) N:N'] 1,2-bis-(pyridin-4-yl)ethane monosolvate].

Project description:The reaction of manganese seleno-cyanate with 1,2-bis-(pyridin-4-yl)ethane (bpa) leads to the title compound, {[Mn(NCSe)2(C12H12N2)(CH3OH)2]·C12H12N2} n . The Mn(II) cation is coordinated by two N-bonded seleno-cyanate anions, two bpa ligands and two O-bonded methanol mol-ecules, within a slightly distorted octa-hedral geometry. The Mn(II) cations and the non-coordinating N-donor ligands are located on centers of inversion while the coordinating N-donor co-ligands are located on a twofold rotation axis. In the crystal, the Mn(II) cations are linked into chains along the c-axis direction by the bpa ligands. The chains are further connected via a non-coordinating bpa ligand into layers parallel to (3-10) via O-H⋯N hydrogen-bonding inter-actions.

| S-EPMC3629498 | biostudies-literature

Bis{1,2-bis-[bis-(3-hydroxy-prop-yl)phosphino]ethane}dichloridoiron(II).

Project description:In the title compound, [FeCl(2)(C(14)H(32)O(4)P(2))(2)], the Fe(II) atom (site symmetry ) adopts a distorted trans-FeCl(2)P(4) octa-hedral geometry with two P,P'-bidentate ligands in the equatorial positions and two chloride ions in the axial positions. In the crystal, mol-ecules are linked by O-H?O and O-H?Cl hydrogen bonds, generating a three-dimensional network.

| S-EPMC2979366 | biostudies-literature

catena-Poly[[diaqua-cadmium(II)]bis-(?-2,2-dimethyl-butane-dioato-?O,O':O'',O''')[diaqua-cadmium(II)]-?-1,4-bis-(3-pyridylmeth-yl)piperazine-?N:N].

Project description:In the title compound, [Cd(2)(C(6)H(8)O(4))(2)(C(16)H(20)N(4))(H(2)O)(4)](n), penta-gonal-bipyramidally coordinated Cd(II) ions are connected into {Cd(2)(2,2-dimethyl-succinate)(2)(H(2)O)(4)} centrosymmetric dimeric clusters. In turn, these clusters are linked by tethering 1,4-bis-(3-pyridylmeth-yl)piperazine (3-bpmp) ligands into [Cd(2)(2,2-dimethyl-succinate)(2)(3-bpmp)(H(2)O)(4)](n) coordination polymer chains. The chain motifs are oriented parallel to [10]. Individual chains are connected into supra-molecular layers via O-H?N and O-H?O hydrogen-bonding mechanisms.

| S-EPMC2979442 | biostudies-literature

Crystal structures of three co-crystals of 1,2-bis-(pyridin-4-yl)ethane with 4-alk-oxy-benzoic acids: 4-eth-oxy-benzoic acid-1,2-bis-(pyridin-4-yl)ethane (2/1), 4-n-propoxybenzoic acid-1,2-bis(pyridin-4-yl)ethane (2/1) and 4-n-but-oxy-benzoic acid-1,2-bis-(pyridin-4-yl)ethane (2/1).

Project description:The crystal structures of three hydrogen-bonded co-crystals of 4-alk-oxy-benzoic acid-1,2-bis-(pyridin-4-yl)ethane (2/1), namely, 2C9H10O3·C12H12N2, (I), 2C10H12O3·C12H12N2, (II), and 2C11H14O3·C12H12N2, (III), have been determined at 93, 290 and 93 K, respectively. In (I), the asymmetric unit consists of one 4-eth-oxy-benzoic acid mol-ecule and one half-mol-ecule of 1,2-bis-(pyridin-4-yl)ethane, which lies on an inversion centre. In (II) and (III), the asymmetric units each comprise two crystallographically independent 4-alk-oxy-benzoic acid mol-ecules and one 1,2-bis-(pyridin-4-yl)ethane mol-ecule. In each crystal, the two components are linked by O-H⋯N hydrogen bonds, forming a linear hydrogen-bonded 2:1unit of the acid and the base. Similar to the structure of 2:1 unit of (I), the units of (II) and (III) adopt nearly pseudo-inversion symmetry. The 2:1 units of (I), (II) and (III) are linked via C-H⋯O hydrogen bonds, forming tape structures.

| S-EPMC4645034 | biostudies-literature

catena-Poly[[[di-aqua-bis-(seleno-cyanato-κN)iron(II)]-μ-1,2-bis-(pyridin-4-yl)ethane-κ(2) N:N'] 1,2-bis-(pyridin-4-yl)ethane disolvate dihydrate].

Project description:The title compound, {[Fe(NCSe)2(C12H12N2)(H2O)2]·2C12H12N2·2H2O} n , was obtained by the reaction of iron(II) sulfate hepta-hydrate and potassium seleno-cyanate with 1,2-bis-(pyridin-4-yl)ethane (bpa) in water. The Fe(II) cation is coordinated by two N-bonded seleno-cyanate anions, two water mol-ecules and two 1,2-bis-(pyridin-4-yl)ethane (bpa) ligands in a slightly distorted octa-hedral geometry. In addition, two non-coordinating bpa mol-ecules and two water mol-ecules are present. The Fe(II) cation is located on a center of inversion while the coordinating bpa ligand is located on a twofold rotation axis. The Fe(II) cations are linked by the bpa ligands into chains along the b-axis direction, which are further connected into layers perpedicular to the c axis by O-H⋯N and O-H⋯O hydrogen bonds to the non-coordin-ating bpa and the water mol-ecules. The crystal studied was twinned by pseudo-merohedry (180° rotation along c*; contribution of the minor twin component 3.7%).

| S-EPMC3684883 | biostudies-literature

1,2-Di-tert-butyl-ethane-1,2-diyl bis-(tert-butane-sulfinamide).

Project description:In the title compound, C(18)H(40)N(2)O(2)S(2), a vicinal diamine derivative, the crystal structure is stabilized by two intra-molecular N-H?O hydrogen bonds. The distance between the two kernel chiral C atoms is 1.580?(2)?Å.

| S-EPMC2968083 | biostudies-other

Diaqua-bis[3-(2-hydroxy-ethyl)-2-methyl-4-oxopyrido[1,2-a]pyrimidin-9-olato-?N,O]manganese(II).

Project description:The title compound, [Mn(C(11)H(11)N(2)O(3))(2)(H(2)O)(2)], consists of discrete mononuclear complex mol-ecules. The Mn(II) atom is located on an inversion center and coordinated by two N atoms and two O atoms, each pair in a trans mode, from two 3-(2-hydroxy-ethyl)-2-methyl-4-oxopyrido[1,2-a]pyrimidin-9-olate ligands and by two water mol-ecules. The coordination geometry around the Mn(II) atom is slightly distorted octa-hedral. Mol-ecules are linked by O-H?O hydrogen bonds into a three-dimensional network.

| S-EPMC2961442 | biostudies-literature

Diaqua-bis-[1,2-bis-(pyridin-4-yl)ethene]-bis-[2-(4-carboxy-phen-yl)acetato]-cobalt(II).

Project description:The asymmetric unit of the title compound, [Co(C(9)H(7)O(4))(2)(C(12)H(10)N(2))(2)(H(2)O)(2)], consists of one Co(2+) ion, one mono-deprotonated 2-(4-carboxyl-atophen-yl)acetate carboxylic acid, one 1,2-bis-(pyridin-4-yl)ethane mol-ecule and one water mol-ecule. The Co(II) atom is situated on a crystallographic center of inversion and is octa-hedrally coordinated by two O atoms from two anions, two N atoms of two 1,2-bis-(pyridin-4-yl)ethane mol-ecules and two O atoms from two water mol-ecules. A three-dimensional network is established by inter-molecular O-H?O and O-H?N hydrogen bonds.

| S-EPMC3152052 | biostudies-literature

Bis{μ-2,2'-[ethane-1,2-diylbis(nitrilo-methyl-idyne)]diphenolato}bis-[(thio-cyanato)manganese(III)].

Project description:The reported structure is a monoclinic polymorph of the title compound, [Mn(2)(C(16)H(14)N(2)O(2))(2)(NCS)(2)], which has been characterized previously in an ortho-rhom-bic form. Each Mn(III) atom is chelated by a tetra-dentate 2,2'-[ethane-1,2-diylbis(nitrilo-methyl-idyne)]diphenolate ligand and by the N atom of a thio-cyanate anion, in a square-pyramidal arrangement. The complexes form centrosymmetric dimers, with an Mn-O contact of 2.557 (3) Å trans to each thio-cyanate anion, completing a distorted octa-hedral coordination geometry.

| S-EPMC2960991 | biostudies-literature

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