Browse
Submit Data
Databases
API
Help

Dataset Information

26 Views

0 Connections

0 Citations

0 Reanalyses

0 Downloads

Omics score: 0

Bis(3-methyl-piperidinium) naphthalene-1,5-disulfonate.

ABSTRACT: The asymmetric unit of the title compound, 2C(6)H(14)N(+)·C(10)H(6)O(6)S(2) (2-), contains one 3-methyl-piperidinium cation and one-half of the centrosymmetric naphthalene-1,5-disulfonate anion. In the crystal, anions and cations are linked through N-H?O hydrogen bonds into layers parallel to (101).

SUBMITTER: Xu Q

PROVIDER: S-EPMC3379283 | biostudies-literature | 2012 Jun

REPOSITORIES: biostudies-literature

ACCESS DATA

Json Xml

Publications

Bis(3-methyl-piperidinium) naphthalene-1,5-disulfonate.

Xu Qian Q

Acta crystallographica. Section E, Structure reports online 20120512 Pt 6

The asymmetric unit of the title compound, 2C(6)H(14)N(+)·C(10)H(6)O(6)S(2) (2-), contains one 3-methyl-piperidinium cation and one-half of the centrosymmetric naphthalene-1,5-disulfonate anion. In the crystal, anions and cations are linked through N-H⋯O hydrogen bonds into layers parallel to (101). ...[more]

PMID: 22719481

Similar Datasets

Bis(2-methyl-piperidinium) naphthalene-1,5-disulfonate.

Project description:In the structure of the title mol-ecular salt, 2C(6)H(14)N(+)·C(10)H(6)O(6)S(2) (2-), the asymmetric unit consists of one 2-methyl-piperidinium cation and one-half of a naphthalene-1,5-disulfonate anion; the anion lies across a centre of symmetry. In the crystal, the cations and anions are linked through N-H?O hydrogen bonds, forming a two-dimensional network.

| S-EPMC3379322 | biostudies-literature

Bis(3-methyl-anilinium) naphthalene-1,5-disulfonate.

Project description:In the crystal of the title mol-ecular salt, 2C(7)H(10)N(+)·C(10)H(6)O(6)S(2) (2-), the naphthalene-1,5-disulfonate anion is located on an inversion center and accepts N-H?O hydrogen bonds from the 3-methyl-anilinium cations, forming supra-molecular layers parallel to the ac plane.

| S-EPMC3379332 | biostudies-literature

Bis(4,4'-methyl-enedianilinium) naphthalene-1,5-disulfonate dihydrate.

Project description:The asymmetric unit of the title salt, C(13)H(16)N(2) (2+)·C(10)H(6)O(6)S(2) (2-)·2H(2)O, consists of one dication located on a general position, half each of two centrosymmetric dianions, and two uncoordinated water mol-ecules in general positions. In the dication, the dihedral angle between the benzene rings is 74.67?(6)°. The cations and anions inter-act through N-H?O hydrogen bonds. The NH(3) (+) functional groups are also involved in N-H?O hydrogen bonds with the water mol-ecules, forming an infinite three-dimensional framework in the crystal structure.

| S-EPMC2961067 | biostudies-literature

Bis(2-methyl-1H-benzimidazol-3-ium) naphthalene-1,5-disulfonate.

Project description:The asymmetric unit of the title compound, 2C(8)H(9)N(2) (+)·C(10)H(6)O(6)S(2) (2-), contains a 2-methyl-benzimidazolium cation and one half of a naphthalene-1,5-disulfonate anion. The formula unit is generated by an inversion center. In the crystal, N-H?O hydrogen bonds link the components into chains along [001]. In addition, weak C-H?O hydrogen bonds and weak C-H?? inter-actions are observed. The methyl H atoms were refined as disordered over two sets of sites with equal occupancy.

| S-EPMC3470333 | biostudies-literature

Bis(diisopropyl-ammonium) naphthalene-1,5-disulfonate.

Project description:In the title compound, 2C(6)H(16)N(+)·C(10)H(6)O(6)S(2) (2-), the cations and anions are associated via N-H?O and C-H?O hydrogen-bonding inter-actions.

| S-EPMC3247441 | biostudies-literature

Bis(trimethyl-ammonium) naphthalene-1,5-disulfonate.

Project description:The asymmetric unit of the title compound, 2C(3)H(10)N(+)·C(10)H(6)S(2)O(6) (2-), contains a half-anion, which is completed by inversion symmetry, and one cation. The cations and anions are associated via strong N-H?O(sulfonate) hydrogen-bonding inter-actions, forming cation-anion-cation groups. Secondary inter-actions such as C-H(ammonium)?O(sulf-on-ate) and van der Waals inter-actions link the cations and anions together in a three-dimensional crystal structure, with zigzag rows of cations lying between layers of anions.

| S-EPMC3254441 | biostudies-literature

Bis(benzimidazolium) naphthalene-1,5-disulfonate trihydrate.

Project description:The title compound, 2C(7)H(7)N(2) (+)·C(10)H(6)O(6)S(2) (2-)·3H(2)O, consists of two crystallographically independent benzimidazolium cations, two independent naphthalene-1,5-disulfonate dianions (both generated by inversion) and three water mol-ecules. These components construct an infinite three-dimensional framework in the crystal structure via O-H⋯O and N-H⋯O hydrogen bonds.

| S-EPMC2960975 | biostudies-literature

Bis(2-methyl-1H-imidazol-3-ium) naphthalene-1,5-disulfonate dihydrate.

Project description:The asymmetric unit of the title organic salt, 2C(4)H(7)N(2) (+)·C(10)H(6)O(6)S(2) (2-)·2H(2)O, consists of a 2-methyl-imidazolium cation, a half of a naphthalene-1,5-disulfonate anion, which lies about a center of symmetry, and a water mol-ecule. In the crystal, N-H?O and O-H?O hydrogen bonds link the cations, anions and water mol-ecules into the layers parallel to (111).

| S-EPMC3379225 | biostudies-literature

Bis(2-trifluoro-methyl-1H-benzimidazol-3-ium) naphthalene-1,5-disulfonate.

Project description:The asymmetric unit of the title compound, C(8)H(6)F(3)N(2) (+)·0.5C(10)H(6)O(6)S(2) (2-), consists of one 2-trifluoro-methyl-1H-benz-imidazol-3-ium cation and a half naphthalene-1,5-disulfate anion, which are linked by an N-H?O hydrogen bond. The anion sits across a centre of symmetry. The atoms of the benzimidazole ring are nearly coplanar (r.m.s. deviation of the fitted atoms = 0.0085?Å) and the triflouromethyl group lies out of this plane. In the crystal, the cations are linked to adjacent anions by N-H?O hydrogen bonds, forming a ladder structure parallel to the a axis in which the anions form the rungs. Adjacent ladders are linked by weak C-H?O inter-actions, forming sheets parallel to the ac plane.

| S-EPMC3275026 | biostudies-literature

Bis(butan-1-aminium) naphthalene-1,5-disulfonate.

Project description:In the title compound, 2C(4)H(12)N(+)·C(10)H(6)O(6)S(2) (2-), the anion lies on an inversion center, so the asymmetric unit contains half an anion and one cation which are linked by a strong N-H?O hydrogen bond. The crystal structure comprises discrete ions, which are linked into centrosymmetric R(4) (4)(12) loops by N-H?O inter-actions.

| S-EPMC3379205 | 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