Browse
Submit Data
Databases
API
Help

Dataset Information

29 Views

0 Connections

0 Citations

0 Reanalyses

0 Downloads

Omics score: 0

2,5-Dichloro-N-(4-meth-oxy-phen-yl)benzensulfonamide.

ABSTRACT: In the title compound, C(13)H(11)Cl(2)NO(3)S, the dihedral angle between the benzene rings is 74.37?(3)°. In the crystal, inter-molecular N-H?O hydrogen bonds link the mol-ecules into chains along the b axis.

SUBMITTER: Khan IU

PROVIDER: S-EPMC3051441 | biostudies-literature | 2011 Jan

REPOSITORIES: biostudies-literature

ACCESS DATA

Json Xml

Publications

2,5-Dichloro-N-(4-meth-oxy-phen-yl)benzensulfonamide.

Khan Islam Ullah IU Bibi Sajida S Mariam Irfana I Sharif Shahzad S Kang Sung Kwon SK

Acta crystallographica. Section E, Structure reports online 20110112 Pt 2

In the title compound, C(13)H(11)Cl(2)NO(3)S, the dihedral angle between the benzene rings is 74.37 (3)°. In the crystal, inter-molecular N-H⋯O hydrogen bonds link the mol-ecules into chains along the b axis. ...[more]

PMID: 21523047

Similar Datasets

3,4-Bis[4-(4-meth-oxy-phen-oxy)phen-yl]-2,5-dihydro-furan-2,5-dione.

Project description:In the crystal structure of the title compound, C(30)H(22)O(7), neighbouring benzene rings are twisted out of the plane of the five-membered ring by 27.30?(3) and 45.47?(3)°.

| S-EPMC3120473 | biostudies-literature

1,1,2,2-Tetra-kis[2,4-dichloro-6-(dieth-oxy-meth-yl)phen-oxy-meth-yl]ethene.

Project description:In the title compound, C(50)H(60)Cl(8)O(12), the mol-ecules are disordered about an inversion center located at the mid-point of the central C=C bond. These atoms show disorder and were modelled with two different orientations with site occupancies of 0.828?(3) and 0.172?(3). The dihedral angle between the two benzene rings in the asymmetric unit is 52.80?(6)°. Intramolecular C-H?O and C-H?Cl interactions occur and the crystal packing features inversion dimers linked by pairs of C-H?O bonds, generating R(2) (2)(10) loops.

| S-EPMC3470353 | biostudies-literature

1-(4-Meth-oxy-phen-yl)pyrrolidine-2,5-dione.

Project description:In the title compound, C11H11NO3, the di-hydro-furan-2,5-dione ring has a shallow envelope conformation, with one of the methyl-ene C atoms displaced by 0.216?(1)?Å from the other atoms. These near-planar atoms subtend a dihedral angle of 55.88?(8)° with the benzene ring. In the crystal, C-H?O hydrogen bonds link the mol-ecules into [010] chains.

| S-EPMC3884492 | biostudies-literature

2,5-Bis(4-meth-oxy-phen-yl)-1,3,4-oxadiazole.

Project description:In the title compound, C(16)H(14)N(2)O(3), the essentially planar 1,3,4-oxadiazole ring [maximum deviation = 0.0021?(11)?Å] is inclined at dihedral angles of 8.06?(6) and 11.21?(6)° with respect to the two benzene rings; the dihedral angle between the latter rings is 11.66?(5)°. In the crystal, short inter-molecular C?O inter-actions [2.9968?(15)?Å] connect adjacent mol-ecules into chains propagating in [203]. The crystal structure is further stabilized by weak inter-molecular C-H?? inter-actions.

| S-EPMC3011497 | biostudies-literature

1-(2-Meth-oxy-phen-yl)-1H-pyrrole-2,5-dione.

Project description:In the title compound, C(11)H(9)NO(3), the dihedral angle between the meth-oxy-benzene and 1H-pyrrole-2,5-dione rings is 75.60 (10)°. The C atom of the meth-oxy group is close to coplanar with its attached ring [deviation = 0.208 (2) Å]. In the crystal, weak aromatic π-π stacking [centroid-centroid separation = 3.8563 (13) Å] occurs between inversion-related pairs of benzene rings.

| S-EPMC3394061 | biostudies-literature

1-(3,5-Dichloro-phen-yl)-3-(2-meth-oxy-phen-yl)triaz-1-ene.

Project description:The title mol-ecule, C(13)H(11)Cl(2)N(3)O, is almost planar and adopts a trans conformation with respect to the -N=N- bond; the dihedral angle between the rings is 3.47?(2)°. The N-N bond lengths indicate the presence of single- and double-bond characters and hence the -N=N-NH- moiety. In the crystal, inversion dimers linked by pairs of N-H?Cl hydrogen bonds occur, and C-H?? and ?-? stacking interactions are also observed.

| S-EPMC3295495 | biostudies-literature

3,4-Bis(4-meth-oxy-phen-yl)-2,5-dihydro-1H-pyrrole-2,5-dione.

Project description:In the title compound, C(18)H(15)NO(4), the benzene rings form quite different dihedral angles [16.07?(1) and 59.50?(1)°] with the central pyrrole ring, indicating a twisted mol-ecule. Conjugation is indicated between the five- and six-membered rings by the lengths of the C-C bonds which link them [1.462?(3) and 1.477?(3)?Å]. The most prominent feature of the crystal packing is the formation of inversion dimers via eight-membered {?HNCO}(2) synthons.

| S-EPMC3344467 | biostudies-literature

3-(2,4-Dichloro-phen-oxy)-1-(4-meth-oxy-phen-yl)-4-(3-nitro-phen-yl)azetidin-2-one.

Project description:In the title compound, C(22)H(16)Cl(2)N(2)O(5), the nearly planar four-membered ?-lactam ring [maximum deviations of 0.011?(2) for the N atom] makes dihedral angles of 68.34?(13), 83.04?(13) and 3.37?(13)° with the dichloro-, nitro- and meth-oxy-phenyl rings, respectively. The crystal structure is stabilized by C-H?O hydrogen-bond inter-actions. In addition, a ?-? stacking inter-action [centroid-centroid distance = 3.6622?(12)?Å] is observed between the ?-lactam and nitro-phenyl rings.

| S-EPMC3050394 | biostudies-literature

2,2-Dichloro-N-(2,5-dichloro-phen-yl)acetamide.

Project description:The conformation of the N-H bond in the title compound, C(8)H(5)Cl(4)NO, is syn to the 2-chloro substituent and anti to the 5-chloro substituent in the aromatic ring. The bond parameters are similar to those in 2,2-dichloro-N-phenyl-acetamide and other acetanilides. In the crystal structure, the mol-ecules are linked into chains through N-H?O hydrogen bonding.

| S-EPMC2915043 | biostudies-literature

(Z)-Methyl 3-(2,4-dichloro-phen-yl)-2-[(2-formyl-phen-oxy)meth-yl]acrylate.

Project description:In the title compound, C(18)H(14)Cl(2)O(4), the mean planes of the methyl acrylate unit and the phenyl ring of the benzaldehyde are approximately orthogonal to each other, making a dihedral angle of 83.31?(6)°. The O atom of the aldehyde group is displaced significantly from the phenyl ring plane by 0.226?(2)?Å. The methyl acrylate group adopts an E conformation. In the crystal, inversion dimers linked by pairs of C-H?O hydrogen bonds generate R(2) (2)(24) loops.

| S-EPMC3201315 | 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