(3Ar,3A'R,8Ar,8A'R)-1,1'-Dimethyl-3A'-[(3As,8As)-1-Methyl-2,3,8,8A-Tetrahydropyrrolo[2,3-B]Indol-3A(1H)-Yl]-1',2,2',3,3',3A',8,8',8A,8A'-Decahydro-1H-3A,7'-Bipyrrolo[2,3-B]Indole

Molecule SVG Image

Properties Simple | Detailed

Formula C30H19N6
IUPAC Name methylidyne-[3-(2-methylidyneammoniophenyl)-3-[(4r)-3,3',7'-trimethylene-2',5-bis(methylidyneammonio)spiro[2h-pyrrole-4,8'-cyclobuta[h]quinolin-1-ium]-4'-yl]prop-1-ynyl]ammonium
Molecular Mass 463.512 g·mol−1
Heat of Formation 377.2 ± 16.7 kJ·mol−1
Dipole Moment 1.72 ± 1.08 D
Volume 634.67 Å 3
Surface Area 452.53 Å 2
HOMO Energy -7.88 ± 0.55 eV
LUMO Energy 3.41 ± eV
Point Group Symmetry C1
Synonyms
  • (3ar,8br)-5,8b-bis[(3ar,8br)-3-methyl-1,2,3a,4-tetrahydropyrrolo[2,3-b]indol-8b-yl]-3-methyl-1,2,3a,4-tetrahydropyrrolo[2,3-b]indole
CAS Number(s)
  • 18210-71-4
InChIKey DPVWJPVYOXKFRQ-BDMNMGLZSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C N