Browse
Submit Data
Databases
API
Help

Dataset Information

0 Views

0 Connections

0 Citations

0 Reanalyses

0 Downloads

Omics score: 0

2-Amino-anilinium 2-chloro-acetate.

ABSTRACT: In the crystal structure of the title compound, C(6)H(9)N(2) (+)·ClCH(2)COO(-), prepared by the reaction of OPDA (orthophenelynediamine) with chloro-acetic -acid, N-H?O hydrogen bonds generate ladder-like chains and very weak inter-molecular C-H?Cl hydrogen-bonding inter-actions between the anions and cations lead to a supra-molecular network. C-H?O inter-actions also occur.

SUBMITTER: Rao AS

PROVIDER: S-EPMC3007232 | biostudies-literature | 2010 Jul

REPOSITORIES: biostudies-literature

ACCESS DATA

Json Xml

Publications

2-Amino-anilinium 2-chloro-acetate.

Rao A Srinivasa AS Tripuramallu Bharat Kumar BK Ravada Kishore K Das Samar K SK

Acta crystallographica. Section E, Structure reports online 20100707 Pt 8

In the crystal structure of the title compound, C(6)H(9)N(2) (+)·ClCH(2)COO(-), prepared by the reaction of OPDA (orthophenelynediamine) with chloro-acetic -acid, N-H⋯O hydrogen bonds generate ladder-like chains and very weak inter-molecular C-H⋯Cl hydrogen-bonding inter-actions between the anions and cations lead to a supra-molecular network. C-H⋯O inter-actions also occur. ...[more]

PMID: 21588271

Similar Datasets

4-Hy-droxy-anilinium 2-chloro-acetate.

Project description:In the crystal of the title salt, C(6)H(8)NO(+)·C(2)H(2)ClO(2) (-), the 4-hy-droxy-anilinium cation links to adjacent chloro-acetate anions via N-H?O and O-H?O hydrogen bonds; weak C-H?O inter-actions also occur between the anions and cations.

| S-EPMC3379443 | biostudies-literature

4-Chloro-anilinium 2-carb-oxy-acetate.

Project description:In the title molecular salt, C(6)H(7)ClN(+)·C(3)H(3)O(4) (-), the components are linked by N-H⋯O and O-H⋯O hydrogen bonds, leading to a two-dimensional network parallel to the bc plane. Weak C-H⋯O inter-actions are also observed.

| S-EPMC3393895 | biostudies-literature

2,4,6-Trimethyl-anilinium chloro-acetate.

Project description:In the crystal structure of the title compound, C(9)H(14)N(+)·C(2)H(2)ClO(2) (-), inter-molecular N-H?O inter-actions link the mol-ecules into a one-dimensional linear structure.

| S-EPMC3213452 | biostudies-other

2-Amino-anilinium 2-carb-oxy-acetate.

Project description:In the crystal structure of the title compound, C(6)H(9)N(2) (+)·C(3)H(3)O(4) (-), all the amino H atoms are involved in inter-molecular N-H?O hydrogen bonds, which link the ions into double chains parallel to [101]. In the anion, an intra-molecular O-H?O hydrogen bond is observed.

| S-EPMC3212276 | biostudies-other

2-Amino-4,6-dimethyl-pyrimidinium chloro-acetate.

Project description:There are two cations and two anions in the asymmetric unit of the title compound, C(6)H(10)N(3) (+)·C(2)H(2)ClO(2) (-). In the crystal, the components are linked by inter-molecular N-H?O and N-H?N hydrogen bonds to form a two-dimensional network. Additional stabilization is provided by weak inter-molecular C-H?O inter-actions.

| S-EPMC2971421 | biostudies-literature

2-Amino-5-chloro-pyridinium trifluoro-acetate.

Project description:The asymmetric unit of the title salt, C(5)H(6)ClN(2) (+)·C(2)F(3)O(2) (-), contains two independent 2-amino-5-chloro-pyridinium cations and two independent trifluoro-acetate anions. The F atoms of both anions are disordered over two sets of positions, with occupancy ratios of 0.672 (12):0.328 (12) and 0.587 (15):0.413 (15). In the crystal, the cations and anions are linked via N-H⋯O and C-H⋯O hydrogen bonds, forming a two-dimensional network parallel to (001).

| S-EPMC2983973 | biostudies-literature

2-Chloro-anilinium perchlorate.

Project description:In the crystal of the title compound, C(6)H(7)ClN(+)·ClO(4) (-), a layer-like structure parallel to the bc plane is formed through N-H⋯O hydrogen bonds between the cations and anions. These layers are connected by weak C-H⋯O inter-actions, forming a three-dimensional network.

| S-EPMC3393925 | biostudies-literature

4-Chloro-anilinium bromide.

Project description:In the title compound, C(6)H(7)ClN(+)·Br(-), the amino N atom is protonated. All non-H atoms of the cation are essentially coplanar [r.m.s. deviation = 0.004 (3) Å]. In the crystal, N-H⋯Br hydrogen bonds connect the ions, forming a ribbon-like structure propagating along [010].

| S-EPMC3393291 | biostudies-literature

2-Amino-6-methyl-pyridinium 2,2,2-tri-chloro-acetate.

Project description:In the asymmetric unit of the title mol-ecular salt, C6H9N2 (+)·C2Cl3O2 (-), there are two independent 2-amino-6-methyl-pyridinium cations and two independent tri-chloro-acetate anions. The pyridine N atom of the 2-amino-6-methyl-pyridine mol-ecule is protonated and the geometries of these cations reveal amine-imine tautomerism. Both protonated 2-amino-6-methyl-pyridinium cations are essentially planar [maximum deviations = 0.026 (2) and 0.012 (2) Å]. In the crystal, the protonated N atom and the 2-amino group of the cation are hydrogen bonded to the carboxyl-ate O atoms of the anion via a pair of N-H⋯O hydrogen bonds, forming an R 2 (2)(8) ring motif. These motifs are connected via N-H⋯O and C-H⋯O hydrogen bonds to form slabs parallel to (101).

| S-EPMC3998557 | biostudies-literature

2-Amino-5-chloro-pyridinium 2-carb-oxy-acetate.

Project description:The title salt, C(5)H(6)ClN(2) (+)·C(3)H(3)O(4) (-), contains two cations and two anions in the asymmetric unit. Both 2-amino-5-chloro-pyridinium ions are protonated at their pyridine N atoms and both hydrogen malonate ions feature an intra-molecular O-H⋯O hydrogen bond, which generates an S(6) ring motif and results in a folded conformation. In the crystal structure, the cations and anions are linked via N-H⋯O, O-H⋯O and C-H⋯O hydrogen bonds, forming chains propagating in [010], which are cross-linked by further C-H⋯O inter-actions.

| S-EPMC2979552 | 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