Browse
Submit Data
Databases
API
Help

Dataset Information

0 Views

0 Connections

0 Citations

0 Reanalyses

0 Downloads

Omics score: 0

2,2'-(Decane-1,10-di-yl)dibenz-imid-azo-lium dichloride trihydrate.

ABSTRACT: The organic cation in the title compound, C(24)H(32)N(4) (2+)·2Cl(-)·3H(2)O, is situated on an inversion centre. The cations, anions and water mol-ecules are linked via N-H?O, N-H?Cl, O-H?O and O-H?Cl hydrogen bonds and C-H?? interactions, forming a three-dimensional framework.

SUBMITTER: Yi JM

PROVIDER: S-EPMC2960893 | biostudies-other | 2008

REPOSITORIES: biostudies-other

ACCESS DATA

Json Xml

Publications

2,2'-(Decane-1,10-di-yl)dibenz-imid-azo-lium dichloride trihydrate.

Yi Jun-Ming JM Zhang Yun-Qian YQ Xue Sai-Feng SF Zhu Qian-Jiang QJ

Acta crystallographica. Section E, Structure reports online 20080312 Pt 4

The organic cation in the title compound, C(24)H(32)N(4) (2+)·2Cl(-)·3H(2)O, is situated on an inversion centre. The cations, anions and water mol-ecules are linked via N-H⋯O, N-H⋯Cl, O-H⋯O and O-H⋯Cl hydrogen bonds and C-H⋯π interactions, forming a three-dimensional framework. ...[more]

PMID: 21202088

Similar Datasets

[2,2'-(2,6,9,13-Tetra-azatetra-decane-1,14-di-yl)diphenolato]iron(III) iodide.

Project description:The title Fe(III) complex, [Fe(C(22)H(32)N(4)O(2))]I, contains a six-coordinate FeN(4)O(2) cation in which the ligand is a reduced Schiff base resulting from the NaBH(4) reduction of the condensation product between salicylaldehyde and 1,5,8,12-tetra-azadodecane. In spite of the increased flexibility of the saturated backbone of the ligand compared to the Schiff base from which it was synthesized, the complex adopts a cis-FeN(4)O(2) conformation for the phenolic O-atom donors, which contrasts with the trans conformation adopted by the analogous ClO(4) (-) salt [Yisgedu et al. (2009 ?). J. Chem. Crystallogr.39, 315-319]. In addition to extensive N-H?I hydrogen bonding between the amine H atoms and the anion there is a weak C-H?I inter-action.

| S-EPMC2979518 | biostudies-literature

2,2'-[1,1'-(Decane-1,10-diyldioxy-dinitrilo)diethyl-idyne]diphenol.

Project description:The salen-type bis-oxime title compound, C(26)H(36)N(2)O(4), lies about a crystallographic inversion centre. Classical intra-molecular O-H?N hydrogen bonds generate two S(6) ring motifs. In the crystal structure, pairs of weak inter-molecular C-H?O hydrogen bonds link adjacent mol-ecules into an infinite one-dimensional supra-molecular structure.

| S-EPMC2977177 | biostudies-literature

4,4'-Di-tert-butyl-2,2'-dipyridinium dichloride.

Project description:In the title compound, C(18)H(26)N(2) (2+)·2Cl(-), the complete dication is generated by crystallographic inversion symmetry; both N atoms are protonated and engaged in strong and highly directional N-H?Cl hydrogen bonds. Additional weak C-H?Cl contacts promote the formation of a tape along ca. [110]. The crystal structure can be described by the parallel packing of these tapes. The crystal studied was a non-merohedral twin with twin law [-1 0 0, 0 -1 0, -0.887 0.179 1] and the final BASF parameter refining to 0.026?(2) .

| S-EPMC3212297 | biostudies-literature

2,2'-(Disulfanedi-yl)dianilinium dichloride dihydrate.

Project description:In the title hydrated mol-ecular salt, C12H14N2S2 (2+)·2Cl(-)·2H2O, the dihedral angle between the benzene rings in the dication is 9.03?(17)° and the C-S-S-C torsion angle is 96.8?(2)°. The crystal packing can be described as alternating organic and anionic water layers lying parallel to (100), which are linked by N-H?Cl and N-H?O hydrogen bonds. O-H?Cl hydrogen bonds and aromatic ?-? stacking inter-actions [centroid-centroid separation = 3.730?(3)?Å] are also observed.

| S-EPMC3770359 | biostudies-literature

2,2'-(1,10-Phenanthrolin-2-ylimino)di-ethanol.

Project description:In the title compound, C(16)H(17)N(3)O(2), symmetry-related mol-ecules are linked into one-dimensional chains along the a axis by a combination of inter-molecular O-H?N and O-H?O hydrogen bonds and weak ?-? stacking inter-actions with a centroid-centroid distance of 3.5494?(12)?Å.

| S-EPMC2968642 | biostudies-literature

2,2'-(Propane-2,2-di-yl)dibenzothia-zole.

Project description:The two symmetry-independent mol-ecules in the asymmetric unit of the title compound, C(17)H(14)N(2)S(2), have similar geometry; the dihedral angles between the least-squares planes of the benzothia-zole groups in the two mol-ecules are 83.93 (3) and 81.26 (3)°.

| S-EPMC2983330 | biostudies-literature

Decane-1,10-diaminium dinitrate.

Project description:The crystal structure of the title compound, C(10)H(26)N(2) (2+)·2NO(3) (-), exhibits a back-to-back paired double-stacked packing arrangement culminating in an overall double zigzag pattern of the dications. Each pair of double-stacked dications is surrounded by a ring of ten nitrate anions. An intricate three-dimensional N---H...O and N---H...(O,O) hydrogen-bonding network exists in the crystal structure.

| S-EPMC3247407 | biostudies-literature

2,2'-(2,2'-Biimidazole-1,1'-di-yl)diethanoic acid.

Project description:In the title compound, C(10)H(10)N(4)O(4), the two imidazole rings adopt a trans conformation and are inclined to one another at a dihedral angle of 55.64 (4)°. In the crystal structure, mol-ecules are linked by inter-molecular O-H⋯N hydrogen bonds into chains running parallel to [010] and layers are formed from these by inter-molecular C-H⋯O hydrogen bonds. Additional C-H⋯O hydrogen bonds produce a three-dimensional network.

| S-EPMC2968835 | biostudies-literature

Redetermination of chlorido(2,2':6',2''-terpyridine-?N,N',N'')gold(I) dichloride trihydrate at 173 K.

Project description:The redetermined structure of the title compound, [AuCl(C(15)H(11)N(3))]Cl(2)·3H(2)O, at 173?(2)?K is reported. The structure displays O-H?Cl and O-H?O hydrogen bonding. The distance of one of the chloride ions from the gold(I) atom [5.047?(1)?Å] differs from that determined previously.

| S-EPMC2959318 | biostudies-literature

4,4'-(Cyclo-hexane-1,1-di-yl)dianilinium dichloride monohydrate.

Project description:In the title compound, C(18)H(24)N(2) (2+)·2Cl(-)·H(2)O, both the cation and the water mol-ecule lie on a twofold crystallographic axis. In the cation, the two benzene rings are perpendicular to each other, making a symmetry-constrained dihedral angle of 90°. In the crystal, N-H⋯Cl, O-H⋯Cl and N-H⋯O hydrogen bonds result in the formation of a three-dimensional network.

| S-EPMC3200667 | 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