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Bis(3-aza-niumylprop-yl)aza-nium hexa-chlorido-bis-muthate(III) monohydrate.

ABSTRACT: The asymmetric unit of the title compound, (C6H20N3)[BiCl6]·H2O, consists of a triprotonated bis-(3-aza-niumylprop-yl)aza-nium cation, two halves of an octahedral [BiCl6](3-) anion, each of the Bi(III) atoms lying on an inversion centre, and a water mol-ecule. In the crystal, the anions and water mol-ecules are linked by O-H⋯Cl hydrogen bonds, forming chains running parallel to [0-11]. The anionic chains and the cations are further linked into a three-dimensional network by N-H⋯Cl and N-H⋯O hydrogen-bond inter-actions.

SUBMITTER: Elfaleh N

PROVIDER: S-EPMC3884999 | biostudies-literature |

REPOSITORIES: biostudies-literature

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2,5-Bis[2-({bis-[3-(dimethyl-aza-nium-yl)prop-yl]aza-nium-yl}meth-yl)phen-yl]-1,3,4-oxadiazole hexa-kis-(perchlorate) sesquihydrate.

Project description:In the title hydrated salt, C36H66N8O(6+)·6ClO4(-)·1.5H2O, the asymmetric unit consists of a hexa-protonated [H6L](6+) cation, five perchlorate anions in general positions, two on twofold rotation axes (one of which is disordered), and two water mol-ecules of crystallization in general positions, one of them disordered around a twofold crystallographic axis. In the [H6L](6+) cation, two strong intra-molecular N-H?N hydrogen bonds occur, involving the N atoms of the oxadiazole ring as acceptors and the closest NH(+) groups of each dipropyl-enetriamine unit. In the crystal, the [H6L](6+) cations form channels along the a-axis direction, in which the perchlorate counter-ions and the water mol-ecules are lodged. The crystal packing features a network of N-H?O and O-H?O hydrogen bonds involving the NH(+) groups of the [H6L](6+) cation, the perchlorate anions and the water mol-ecules.

| S-EPMC3589030 | biostudies-literature

Chloridobis(1,10-phenanthroline)zinc(II) tetra-chlorido(1,10-phenan-throline)bis-muthate(III) monohydrate.

Project description:In the crystal structure of the title monohydrate salt, [ZnCl(C(12)H(8)N(2))(2)][BiCl(4)(C(12)H(8)N(2))]·H(2)O, the ionic components are linked into three-dimensional supra-molecular channels by five pairs of C-H?Cl hydrogen bonds and ?-? stacking inter-actions with an inter-planar distance of 3.643?(2)?Å. The solvent water mol-ecules are lodged in the channels.

| S-EPMC3050139 | biostudies-literature

3-(Amino-carbon-yl)pyridinium diaqua-bis-(pyridine-2,6-dicarboxyl-ato)bis-muthate(III) monohydrate.

Project description:The asymmetric unit of the ionic title compound, (C(6)H(7)N(2)O)[Bi(C(7)H(3)NO(4))(2)(H(2)O)(2)]·H(2)O or (acpyH)[Bi(pydc)(2)(H(2)O)(2)]·H(2)O, contains an [Bi(pydc)(2)(H(2)O)(2)](-) anion (where pydcH(2) is pyridine-2,6-dicarb-oxy-lic acid), a protonated 3-(amino-carbon-yl)pyridine as counter-ion, (acpyH)(+), and one uncoordinated water mol-ecule. The anion is an eight-coordinate complex with a square-anti-prismatic geometry around the Bi(III) atom. In the crystal, extensive O-H?O and N-H?O hydrogen bonds, as well as ion pairing, C=O?? inter-actions [O?centroid distance = 3.583?(5)?Å], ?-? stacking [centroid-centroid distance = 3.864?(3)?Å], and C-H?? and C-H?O inter-actions, play an important role in the formation and stabilization of the three-dimensional supra-molecular structure.

| S-EPMC3393208 | biostudies-literature

catena-Poly[[trimeth-yl(4-sulfanylphen-yl)aza-nium] [(chloridocadmate)-di-?-chlorido]].

Project description:The title compound, {(C(9)H(14)NS)[CdCl(3)]}(n), consists of a linear [CdCl(3)](n) (n) (-) polyanion and a trimeth-yl(4-sulfanylphen-yl)aza-nium cation. The Cd(II) atom is penta-coordinated by four ?(2)-Cl atoms and one terminal Cl atom in a trigonal-bipyramidal geometry. The trigonal-bipyramidal units are linked by two opposite shared faces, giving rise to infinite [CdCl(3)](n) chains parallel to the a axis. The cations surround the chain and are linked to them by S-H?Cl and C-H?Cl hydrogen bonds, forming a three-dimensional network.

| S-EPMC3238767 | biostudies-literature

Bis(piperazine-1,4-diium) hexa-chlorido-bismuthate(III) chloride monohydrate.

Project description:The crystal structure of the title compound, (C(4)H(12)N(2))(2)[BiCl(6)]Cl·H(2)O, consists of piperazinediium cations, [BiCl(6)](3-) anions, Cl(-) anions and uncoordinated water mol-ecules. The Bi(III) cation is coordinated by six Cl(-) anions in a slightly distorted octa-hedral geometry. The diprotonated piperazine ring adopts a chair conformation. In the crystal, extensive inter-molecular N-H?Cl, N-H?O and O-H?Cl hydrogen bonds occur.

| S-EPMC3238614 | biostudies-other

2-[(2-Hy-droxy-eth-yl)aza-nium-yl]ethanaminium oxalate monohydrate.

Project description:In the title hydrated mol-ecular salt, C(4)H(14)N(2)O(2+)·C(2)O(4) (2-)·H(2)O, the oxalate dianion is almost planar (r.m.s. deviation = 0.020?Å). In the crystal, the components are linked by N-H?O(water), N-H?O(oxalate) O-H(ammonium)?O(oxalate), O-H(water)?O(oxalate) and O-H(water)?O(ammonium) hydrogen bonds, thereby forming a complex three-dimensional packing motif.

| S-EPMC3275022 | biostudies-literature

Bis[eth-yl(2-hydroxy-ethyl)aza-nium] 2,2'-disulfanediyldibenzoate.

Project description:The asymmetric unit of the title salt, 2C(4)H(12)NO(+)·C(14)H(8)O(4)S(2) (2-), contains an eth-yl(2-hydr-oxy)aminium cation and half a 2,2'-disulfanediyldibenzoate anion, with the latter disposed about a twofold axis. The cation is a straight chain with the exception of the terminal hydr-oxy group [the N-C-C-O torsion angle is 66.5?(2)°]. A twisted conformation is found for the anion [the C-S-S-C torsion angle is 91.51?(9)° and the dihedral angle between the rings is 81.01?(4)°]. A supra-molecular chain with base vector [101] and a tubular topology is formed in the crystal structure mediated by charge-assisted O-H?O(-) and N(+)-H?O(-) hydrogen bonding.

| S-EPMC2983623 | biostudies-literature

Tri-?-chlorido-bis-[(?-hexa-methyl-benzene)-ruthenium(II)] tetra-chlorido-ferrate(III).

Project description:The mol-ecular geometry of the complex cation in the title structure, [(?-Cl)(3){Ru(II)(?(6)-C(6)Me(6))}(2)][Fe(III)Cl(4)], compares very well with that reported earlier for the corresponding PF(6) (-) salt [Pandey et al. (1999 ?). J. Organomet. Chem.592, 278-282]. The [FeCl(4)](-) counter ion has a rather regular tetra-hedral geometry with Fe-Cl distances and Cl-Fe-Cl angles in the range 2.1891?(7)-2.2018?(8)?Å and 107.10?(3)-110.56?(3)°, respectively. There are no significant inter-molecular inter-actions in the crystal except for some weak C-H?Cl contacts, which in turn indicates that the crystal packing is determined predominantly by electrostatic inter-actions between the ionic constituents.

| S-EPMC3201229 | biostudies-literature

[2-Acet-oxy-3-(naphthalen-1-yl-oxy)prop-yl](propan-2-yl)aza-nium chloride monohydrate.

Project description:The title compound, C18H24NO3 (+)·Cl(-)·H2O, was synthesized by the reaction of propranolol hydro-chloride with acetyl chloride in chloro-form followed by slow evaporation in air. In the cation, the dihedral angle between the planes of the naphthalene ring system and the acetate group is 71.1?(2)°. An intra-molecular N-H?O hydrogen bond results in the formation of a non-planar pseudo-ring, with the ether O and the H atom displaced by -1.328?(2) and 0.65?Å, respectively, from the plane of the other ring atoms. The cation and anion are linked by an N-H?Cl hydrogen bond. The water molecule is linked to a methyl H atom by C-H?O hydrogen bond.

| S-EPMC3629540 | biostudies-literature

Hexa-?-chlorido-hexa-chlorido(?-hexa-methyl-benzene)trialuminium(III)lanthanum(III) benzene solvate.

Project description:In the title compound, [Al(3)LaCl(12)(C(12)H(18))]·C(6)H(6), all mol-ecules are located on a mirror plane. Three chloridoaluminate groups and a hexa-methyl-benzene mol-ecule are bound to the central lanthanum(III) ion, forming a distorted penta-gonal bipyramid with the ?(6)-coordinated arene located at the apical position. The hexa-methyl-benzene ligand disordered between two orientations in a 1:1 ratio is also involved in parallel-slipped ?-? stacking inter-molecular inter-actions with a benzene solvent mol-ecule [centroid-centroid distance 3.612?(4)?Å].

| S-EPMC2968558 | biostudies-literature

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