Browse
Submit Data
Databases
API
Help

Dataset Information

0 Views

0 Connections

0 Citations

0 Reanalyses

0 Downloads

Omics score: 0

N-Benzoyl-3-nitro-benzene-sulfonamide.

ABSTRACT: In the title compound, C(13)H(10)N(2)O(5)S, the dihedral angle between the phenyl and benzene rings is 86.7?(1)°. In the crystal, mol-ecules are linked into zigzag C(4) chains running along the b axis via N-H?O hydrogen bonds.

SUBMITTER: Suchetan PA

PROVIDER: S-EPMC3239136 | biostudies-literature | 2011 Dec

REPOSITORIES: biostudies-literature

ACCESS DATA

Json Xml

Publications

N-Benzoyl-3-nitro-benzene-sulfonamide.

Suchetan P A PA Foro Sabine S Gowda B Thimme BT

Acta crystallographica. Section E, Structure reports online 20111130 Pt 12

In the title compound, C(13)H(10)N(2)O(5)S, the dihedral angle between the phenyl and benzene rings is 86.7 (1)°. In the crystal, mol-ecules are linked into zigzag C(4) chains running along the b axis via N-H⋯O hydrogen bonds. ...[more]

PMID: 22199984

Similar Datasets

N-Benzoyl-4-nitro-benzene-sulfonamide monohydrate.

Project description:In the title compound, C(13)H(10)N(2)O(5)S·H(2)O, the dihedral angle between the sulfonyl and benzoyl benzene rings is 83.4?(1)°. In the crystal, the water mol-ecule forms four hydrogen bonds with three different mol-ecules of N-benzoyl-4-nitro-benzene-sulfonamide. One of the H atoms of H(2)O forms a bifurcated hydrogen bond with a sulfonyl and the carbonyl O atoms. Mol-ecules are linked into a three-dimensional network by N-H?O and O-H?O hydrogen bonds.

| S-EPMC3254351 | biostudies-literature

N-Benzoyl-2-nitro-benzene-sulfonamide.

Project description:In the title compound, C(13)H(10)N(2)O(5)S, the N-C bond in the C-SO(2)-NH-C segment has gauche torsion angles with respect to the S=O bonds. The conformation between the N-H bond and the ortho-nitro group in the sulfonyl benzene ring is syn. The mol-ecule is twisted at the S-N bond with a torsion angle of -63.4?(2)°. The sulfonyl benzene ring is tilted by 77.1?(1)° relative to the -SO(2)-NH-C-O segment. The dihedral angle between the sulfonyl and the benzoyl benzene rings is 88.6?(1)°. In the crystal, pairs of N-H?O(S) hydrogen bonds link the mol-ecules into inversion dimers, which are linked by weak C-H?O and C-H?? inter-actions along the b axis.

| S-EPMC3275024 | biostudies-other

N-Benzoyl-4-methyl-benzene-sulfonamide.

Project description:In the title compound, C(14)H(13)NO(3)S, the N-H bond in is anti to the C=O bond. The dihedral angle between the two aromatic rings is 79.4?(1)°. In the crystal, mol-ecules are linked by N-H?O hydrogen bonds, generating C(4) chains.

| S-EPMC2979201 | biostudies-literature

N-Benzoyl-2-chloro-benzene-sulfonamide.

Project description:In the crystal structure of the title compound, C(13)H(10)ClNO(3)S, the conformation of the of the N-H bond in the C-SO(2)-NH-C(O) segment is anti to the C=O bond. The dihedral angle between the two benzene rings is 73.3?(1)°. In the crystal, inversion dimers linked by pairs of N-H?O hydrogen bonds occur.

| S-EPMC2984022 | biostudies-literature

N-Benzoyl-2-methyl-benzene-sulfonamide.

Project description:In the title compound, C(14)H(13)NO(3)S, the conformation of the N-H bond in the C-SO(2)-NH-C(O) segment is anti to the C=O bond. The tolyl and benzoyl groups are twisted about the S-N bond, with a C-S-N-C torsion angle of 68.8?(4)°. The dihedral angle between the sulfonyl and the benzoyl benzene rings is 73.9?(1)°. In the crystal, the mol-ecules are linked into C(4) chains along the c axis by N-H?O hydrogen bonds.

| S-EPMC2979050 | biostudies-literature

N-Benzoyl-4-chloro-benzene-sulfonamide.

Project description:The asymmetric unit of the title compound, C(13)H(10)ClNO(3)S, contains two independent mol-ecules. The mol-ecules have C-S-N-C torsion angles of -70.0?(2) and 61.3?(2)° for mol-ecules 1 and 2, respectively. The dihedral angles between the sulfonyl benzene rings and the -SO(2)-NH-C-O segments are 72.0?(1) and 77.3?(1)° for mol-ecules 1 and 2, respectively, and the dihedral angles between the sulfonyl and the benzoyl benzene rings are 62.8?(1) and 78.6?(1)°, respectively. In the crystal, mol-ecules 1 and 2 are linked by pairs of N-H?O hydrogen bonds, forming inversion dimers.

| S-EPMC2983762 | biostudies-literature

4-Nitro-N-phenyl-benzene-sulfonamide.

Project description:In the title compound, C(12)H(10)N(2)O(4)S, the dihedral angle between the aromatic rings is 36.19?(18)°. In the crystal, N-H?O hydrogen bonds link the mol-ecules into C(4) chains running along the a axis.

| S-EPMC3470227 | biostudies-literature

2-Methyl-5-nitro-benzene-sulfonamide.

Project description:In the title compound, C(7)H(8)N(2)O(4)S, the nitro group is twisted by 9.61?(2)° relative to the benzene ring. In the crystal, mol-ecules are linked by N-H?O and N-H?(O,O) hydrogen bonds between the amino and sulfonyl groups, forming layers parallel to (001).

| S-EPMC2980036 | biostudies-literature

2-Nitro-N-phenyl-benzene-sulfonamide.

Project description:In the title compound, C(12)H(10)N(2)O(4)S, the conformation of the N-H bond in the -SO(2)-NH- fragment is syn to the ortho-nitro group in the sulfonyl-benzene ring. The mol-ecule is twisted at the S-N bond, the C-N-S-C torsion angle being -72.83 (15)°. The dihedral angle between the benzene rings is 59.55 (7)°. The amide H atom and the nitro group O atom form an intra-molecular hydrogen bond, generating an S(7) motif. In the crystal, C-H⋯O hydrogen-bond inter-actions link the mol-ecules into S(2) (2)(10) networks.

| S-EPMC3435678 | biostudies-literature

N-(3-Nitro-benzo-yl)benzene-sulfonamide.

Project description:In the title compound, C(13)H(10)N(2)O(5)S, the C=O bond in the -SO(2)-NH-CO- segment is anti to the meta-nitro group in the benzoyl ring, while the N-C bond has gauche torsions with respect to the S=O bonds. The molecule is twisted at the N atom with a dihedral angle of 79.9 (2)° between the sulfonyl benzene ring and the -SO(2)-NH-CO- segment. Furthermore, the dihedral angle between the benzeneline rings is 86.9 (2)°. In the structure, the mol-ecules are linked into helical chains along the b axis via N-H⋯O hydrogen bonds.

| S-EPMC3344615 | 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