Browse
Submit Data
Databases
API
Help

Dataset Information

0 Views

0 Connections

0 Citations

0 Reanalyses

0 Downloads

Omics score: 0

12-Chloro-6-cyclo-hexyl-5,6,7,12-tetra-hydro-dibenzo[c,f][1,5]aza-stibocine.

ABSTRACT: In the title organometallic complex, [Sb(C(20)H(23)N)Cl], the central anti-mony-containing part of the complex exhibits a pseudo-trigonal-bipyramidal geometry, where two C atoms and a lone electron pair of the Sb atom exist at the equatorial positions, while the N and Cl atoms are located at the apical positions, and a transannular inter-action exists between the Sb and N atoms on 1,5-aza-stibocine. Inter-molecular C-H?Cl hydrogen bonds are also observed.

SUBMITTER: Yi W

PROVIDER: S-EPMC3151782 | biostudies-literature | 2011 Jul

REPOSITORIES: biostudies-literature

ACCESS DATA

Json Xml

Publications

12-Chloro-6-cyclo-hexyl-5,6,7,12-tetra-hydro-dibenzo[c,f][1,5]aza-stibocine.

Yi Weiguo W Tan Nianyuan N

Acta crystallographica. Section E, Structure reports online 20110611 Pt 7

In the title organometallic complex, [Sb(C(20)H(23)N)Cl], the central anti-mony-containing part of the complex exhibits a pseudo-trigonal-bipyramidal geometry, where two C atoms and a lone electron pair of the Sb atom exist at the equatorial positions, while the N and Cl atoms are located at the apical positions, and a transannular inter-action exists between the Sb and N atoms on 1,5-aza-stibocine. Inter-molecular C-H⋯Cl hydrogen bonds are also observed. ...[more]

PMID: 21836902

Similar Datasets

6-Cyclo-hexyl-6,7-dihydro-dibenzo[c,f][1,5]aza-bis-mocin-12(5H)-yl(N→Bi) trifluoro-methane-sulfonate.

Project description:In the title compound, [Bi(C(20)H(23)N)(CF(3)SO(3))], the Bi(III) ion shows a distorted pseudo-trigonal-bipyramidal geometry, with two C atoms and a lone electron pair of the Bi atom in equatorial positions and the N and O atoms at the apical positions. The cyclo-hexyl group is disordered over two orientations with site-occupancy factors of 0.600 (14) and 0.400 (14).

| S-EPMC3051572 | biostudies-literature

6-(1-Methyl-ethyl)-12-phenyl-5,6,7,12-tetra-hydro-dibenz[c,f][1,5]aza-silocine.

Project description:The title compound, C(23)H(25)NSi, has an eight-membered silicon-containing heterocyclic ring with an intra-molecular N?Si close contact, the transannular distance of which is 2.6294?(18)?Å. The resulting geometry about the Si atom is distorted trigonal-bypyramidal, with the N and H atoms occupying apical sites. The dihedral angle between the aromatic rings fused to the eight-membered ring is 63.27?(7)°.

| S-EPMC2980245 | biostudies-literature

2-Cyclo-hexyl-4-methyl-tetra-hydro-pyran-4-ol.

Project description:In the title compound, C(12)H(22)O(2), the 4-methyl-tetra-hydro-pyran-4-ol ring adopts a conformation close to that of a chair and with the two O atoms syn; the cyclo-hexyl group occupies an equatorial position and adopts a chair conformation. In the crystal packing, supra-molecular chains along the b axis are sustained by O-H?O hydrogen bonds. These are connected into undulating layers in the ab plane by C-H?O inter-actions.

| S-EPMC2979019 | biostudies-literature

7-Chloro-5-cyclo-propyl-9-methyl-5H-4,5,6,10-tetra-aza-dibenzo[a,d]cyclo-hepten-11(10H)-one.

Project description:In the title compound, C(15)H(13)ClN(4)O, which is a chloro derivative of the drug Nevirapine, the diazepine ring is in a twisted boat conformation. The pyridine rings fused to the diazepine fragment form a dihedral angle of 58.44?(10)° and the mol-ecule adopts a butterfly shape. The mol-ecules are joined via N-H?N hydrogen bonding into polymeric chains down the b axis. All weaker C-H?O inter-actions involve the carbonyl O atom as acceptor.

| S-EPMC3120426 | biostudies-other

2-Chloro-12-phenyl-6,7,8,9,10,11-hexa-hydro-cyclo-octa-[b]quinoline.

Project description:In the mol-ecule of the title compound, C(21)H(20)ClN, the quinoline group is nearly planar and is oriented at a dihedral angle of 77.21 (3)° with respect to the phenyl ring. The conformation of the cyclooctane ring is twist-boat. In the crystal structure, there are some weak π-π inter-actions [centroid-to-centroid distances of 3.7414 (11) and 3.8633 (12) Å] between the rings of the quinoline groups.

| S-EPMC2961081 | biostudies-literature

2-Chloro-7,8,9,10-tetra-hydro-cyclo-hepta-[b]indol-6(5H)-one.

Project description:In the title mol-ecule, C(13)H(12)ClNO, the dihedral angle between the benzene and pyrrole rings is 1.38?(9)°. The cyclo-heptene ring adopts a distorted twist chair and sofa conformation. Inter-molecular N-H?O hydrogen bonds form an R(2) (2)(10) loop in the crystal packing. Further, weak C-H?O and C-H?? (involving the benzene ring) inter-actions are found in the crystal structure.

| S-EPMC3379447 | biostudies-literature

5-Chloro-acetyl-4-methyl-2,3,4,5-tetra-hydro-1H-1,5-benzodiazepin-2-one.

Project description:In the title compound, C(12)H(13)ClN(2)O(2), the benzodiazepine ring adopts a distorted boat conformation. The carbonyl O atom and the Cl atom of the chloro-acetyl group are in a cis conformation. The crystal packing is controlled by inter-molecular C-H?O and N-H?O inter-actions.

| S-EPMC2970477 | biostudies-literature

4-Chloro-N-cyclo-hexyl-benzamide.

Project description:In the title compound, C(13)H(16)ClNO, the cyclo-hexyl ring adopts a chair conformation, with puckering parameters Q = 0.576?(3)?Å, ? = 0.1?(3) and ? = 8?(15)°. In the crystal structure, inter-molecular N-H?O hydrogen bonds link mol-ecules into one-dimensional chains propagating in [010].

| S-EPMC2969216 | biostudies-literature

3-Chloro-N-cyclo-hexyl-benzamide.

Project description:In the title mol-ecule, C(13)H(16)ClNO, the mean plane of the atoms in the -CONH- group forms a dihedral angle of 42.0 (4)° with the benzene ring plane. In the crystal structure, mol-ecules are linked by inter-molecular N-H⋯O hydrogen bonds, generating C(4) chains along [100].

| S-EPMC2969806 | biostudies-literature

[6,13-Bis(2,4-dichloro-benzo-yl)-5,7,12,14-tetra-methyl-dibenzo[b,i][1,4,8,11]tetra-aza-cyclo-tetra-decinato- ??N]nickel(II) acetone monosolvate.

Project description:In the title complex, [Ni(C??H??Cl?N?O?)]·C?H?O, two 2,4-dichloro-benzoyl groups are grafted onto the methine groups of the Ni(II) complex Ni(tmtaa) (H?tmtaa = 5,7,12,14-tetra-methyl-4,11-dihydro-dibenzo[b,i][1,4,8,11]tetra-aza-cyclo-tetra-decine). The complex has the shape of a saddle. The Ni atom is tetra-coordinated by the four N atoms of the macrocycle, forming a slightly tetra-hedrally distorted square-planar geometry. The metal is displaced by 0.0101?(8)?Å from the N? mean plane. The aromatic rings of the 2,4-dichloro-benzoyl groups form dihedral angles of 87.1?(2) and 82.1?(2)° with the N? mean plane.

| S-EPMC3393152 | 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