Browse
Submit Data
Databases
API
Help

Dataset Information

0 Views

0 Connections

0 Citations

0 Reanalyses

0 Downloads

Omics score: 0

N-(4-Chloro-phen-yl)-3,4,5-trimethoxy-benzamide.

ABSTRACT: In the title compound, C(16)H(16)ClNO(4), the dihedral angle between the two aromatic rings is 67.33?(8)°. The crystal packing shows strong inter-molecular N-H?O hydrogen bonds that link the mol-ecules to form chains along [01].

SUBMITTER: Saeed A

PROVIDER: S-EPMC2962079 | biostudies-other | 2008

REPOSITORIES: biostudies-other

ACCESS DATA

Json Xml

Publications

N-(4-Chloro-phen-yl)-3,4,5-trimethoxy-benzamide.

Saeed Aamer A Khera Rasheed Ahmad RA Batool Mahira M Shaheen Uzma U Flörke Ulrich U

Acta crystallographica. Section E, Structure reports online 20080731 Pt 8

In the title compound, C(16)H(16)ClNO(4), the dihedral angle between the two aromatic rings is 67.33 (8)°. The crystal packing shows strong inter-molecular N-H⋯O hydrogen bonds that link the mol-ecules to form chains along [01]. ...[more]

PMID: 21203315

Similar Datasets

N-(3,4-Difluoro-phen-yl)-3,4,5-trimethoxy-benzamide.

Project description:In the title amide, C(16)H(15)F(2)NO(4), the dihedral angle between the benzene rings is 2.33?(15)°. Mol-ecules are linked in the crystal structure by N-H?O hydrogen bonding involving N-H and C=O groups of the amide function, leading to a supra-molecular chain along [100].

| S-EPMC2979189 | biostudies-literature

N-(3-Bromo-phen-yl)-3,4,5-trimethoxy-benzamide.

Project description:In the title compound, C(16)H(16)BrNO(4), the dihedral between the planes of the aromatic rings is 7.74?(18)°. The amide group is tilted with respect to the bromo- and meth-oxy-substituted aromatic rings by 36.3?(8) and 35.2?(8)°, respectively. The meta-meth-oxy groups are essentially in-plane with the aromatic ring [dihedral angles CH(3)-O-C-C = -4.6?(4) and -2.5?(4)°]. The para-meth-oxy group is markedly displaced from the ring plane [dihedral angle CH(3)-O-C-C = -72.5?(4)°]. The crystal packing is stabilized by N-H?O hydrogen bonds linking the mol-ecules into chains running along the b axis.

| S-EPMC2969324 | biostudies-literature

2-(3,4,5-Trimethoxy-phen-yl)-1H-benzimidazole.

Project description:In the title compound, C(16)H(16)N(2)O(3), the dihedral angle between the mean planes of the aromatic ring systems is 30.90?(15)°. In the crystal structure, the mol-ecules form [010] chains by way of N-H?N hydrogen bonds.

| S-EPMC2961418 | biostudies-literature

N-Cyclo-hexyl-3,4,5-trimethoxy-benzamide.

Project description:The 3,5-meth-oxy groups in the title compound, C(16)H(23)NO(4), are almost coplanar with the aromatic ring, whereas the 4-meth-oxy group is bent out of this plane. The three CH(3)-O-C-C torsion angles are -1.51?(18), 0.73?(19) and 75.33?(15)°. The cyclo-hexane ring adopts a chair conformation. In the crystal, mol-ecules are connected by inter-molecular N-H?O hydrogen bonds into chains running along the b axis.

| S-EPMC2972029 | biostudies-literature

5-Meth-oxy-1-(3,4,5-trimethoxy-phen-yl)-1H-indole.

Project description:The title compound, C(18)H(19)NO(4), was prepared as an indole derivative with possible anti-mitotic properties. The planes of the indole and trimethoxy-phenyl rings make a dihedral angle of 45.35?(5)° with one another. In the crystal, mol-ecules related by a twofold screw axis exhibit arene C-H?arene-? inter-actions which are 3.035?(1)?Å in length.

| S-EPMC3007039 | biostudies-literature

1-(2-Fluoro-phen-yl)-3-(3,4,5-trimethoxy-benzo-yl)thio-urea.

Project description:The two m-meth-oxy groups of the title compound, C(17)H(17)FN(2)O(4)S, are almost coplanar with the aromatic ring [CH(3)-O-C-C = 5.8?(1) and 5.9?(1)°], whereas the meth-oxy group in the para position is bent out of the ring plane [78.6?(1)°]. Mol-ecules are connected by inter-molecular N-H?S hydrogen bonds to form centrosymmetric dimers that are stacked along the a axis.

| S-EPMC2979251 | biostudies-literature

N-(3-Chloro-phen-yl)benzamide.

Project description:The conformation of the N-H bond in the structure of the title compound (N3CPBA), C(13)H(10)ClNO, is anti to the meta chloro substituent in the aniline benzene ring, similar to that observed with respect to the ortho chloro substituent in N-(2-chloro-phen-yl)benzamide (N2CPBA) and meta chloro substituent in N-(3,4-dichloro-phen-yl)benzamide (N34DCPBA), but in contrast to the syn conformation observed with respect to both the ortho and the meta chloro substituents in N-(2,3-dichloro-phen-yl)benzamide (N23DCPBA). The bond parameters in N3CPBA are similar to those in N-phenyl-benzamide, N2CPBA, N23DCPBA, N34DCPBA and other benzanilides. The amide group -NHCO- makes a dihedral angle of 18.2 (2)° with the benzoyl ring, while the dihedral angle between the two benzene rings is 61.0 (1)°. The mol-ecules are linked into chains along the b axis by N-H⋯O hydrogen bonds.

| S-EPMC2960316 | biostudies-literature

3-Chloro-N-(3-chloro-phen-yl)benzamide.

Project description:In the crystal structure of the title compound, C(13)H(9)Cl(2)NO, the N-H and C=O bonds are anti to each other in the two independent mol-ecules. In one mol-ecule, the N-H bond is syn to the meta-chloro group of the attached ring; it is anti in the other mol-ecule. This relationship is also observed between the C=O bond and the meta-chloro substituent of its attached ring. The amide -NHCO- group makes dihedral angles of 31.5?(4) and 34.7?(3)° with the aniline rings; it makes dihedral angles of 37.4?(3) and 37.2?(3)° with the benzoyl rings. The two rings are nearly coplanar, with dihedral angles of 9.1?(2) and 7.3?(3)° in the two independent mol-ecules. Adjacent mol-ecules are linked into infinite chains through N-H?O hydrogen bonds.

| S-EPMC2961234 | biostudies-literature

4-Chloro-N-(2-chloro-phen-yl)benzamide.

Project description:In the mol-ecular structure of the title compound, C(13)H(9)Cl(2)NO, the amide N-C=O plane makes dihedral angles of 31.53?(8) and 36.23?(8)°, respectively, with the 4-chloro- and 2-chloro-phenyl rings. The dihedral angle between the two benzene rings is 6.25?(8)°. The mol-ecules are stacked in columns along the b axis through inter-molecular N-H?O hydrogen bonds. The columns are further connected by weak C-H?O hydrogen bonds. The compound is not isomorphous with the fluoro analogue.

| S-EPMC2959385 | biostudies-literature

3-Chloro-N-(2-chloro-phen-yl)benzamide.

Project description:In the title compound, C(13)H(9)Cl(2)NO, the meta-Cl atom in the benzoyl ring is positioned anti to the C=O bond, while the ortho-Cl atom in the aniline ring is positioned syn to the N-H bond. The two aromatic rings are almost coplanar, making a dihedral angle of 4.73?(5)°. The crystal structure is stabilized by N-H?O hydrogen bonds, which link the mol-ecules into chains along the b axis.

| S-EPMC3254408 | 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