(3As,8Ar)-3A,8-Dimethyl-1-(2-Phenylethyl)-1,2,3,3A,8,8A-Hexahydropyrrolo[2,3-B]Indol-5-Yl (4-Isopropylphenyl)Carbamate

Molecule SVG Image

Properties Simple | Detailed

Formula C30H35N3O2
IUPAC Name [(3ar,8bs)-4,8b-dimethyl-3-(2-phenylethyl)-2,3a-dihydro-1h-pyrrolo[2,3-b]indol-7-yl] n-(4-propan-2-ylphenyl)carbamate
Molecular Mass 469.618 g·mol−1
Heat of Formation -132.4 ± 16.7 kJ·mol−1
Dipole Moment 1.95 ± 1.08 D
Volume 599.23 Å 3
Surface Area 505.82 Å 2
HOMO Energy -8.14 ± 0.55 eV
LUMO Energy 3.15 ± eV
Point Group Symmetry C1
Synonyms
  • [(3ar,8bs)-4,8b-dimethyl-3-(2-phenylethyl)-2,3a-dihydro-1h-pyrrolo[2,3-b]indol-7-yl] n-(4-isopropylphenyl)carbamate
  • n-(4-isopropylphenyl)carbamic acid [(3ar,8bs)-4,8b-dimethyl-3-(2-phenylethyl)-2,3a-dihydro-1h-pyrrolo[2,3-b]indol-7-yl] ester
InChIKey WKDFOVDLOVYRAJ-JDXGNMNLSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N