7-{[7-{[(3Br,4As)-3-Methyl-8-Oxo-1,4A,5,8-Tetrahydrocyclopropa[C]Pyrrolo[3,2-E]Indol-6(4H)-Yl]Carbonyl}-1,6-Dihydropyrrolo[3,2-E]Indol-3(2H)-Yl]Carbonyl}-1,6-Dihydropyrrolo[3,2-E]Indole-3(2H)-Carboxamide

Molecule SVG Image

Properties Simple | Detailed

Formula C35H29N7O4
IUPAC Name 7-{[7-{[(3br,4as)-3-methyl-8-oxo-1,4a,5,8-tetrahydrocyclopropa[c]pyrrolo[3,2-e]indol-6(4h)-yl]carbonyl}-1,6-dihydropyrrolo[3,2-e]indol-3(2h)-yl]carbonyl}-1,6-dihydropyrrolo[3,2-e]indole-3(2h)-carboxamide
Molecular Mass 611.649 g·mol−1
Heat of Formation 36.6 ± 16.7 kJ·mol−1
Dipole Moment 10.43 ± 1.08 D
Volume 682.62 Å 3
Surface Area 577.8 Å 2
HOMO Energy -8.35 ± 0.55 eV
LUMO Energy -0.93 ± eV
Point Group Symmetry C1
Synonyms
  • (+)-ab'c'
  • 7-((1,6-dihydro-7-((4,5,8,8a-tetrahydro-7-methyl-4-oxocyclopropa(c)pyrrolo(3,2-e)indol-2(1h)-yl)carbonyl)benzo(1,2-b:4,3-b')dipyrrol-3(2h)-yl)carbonyl)-1,6-dihydrobenzo(1,2-b:4,3-b')dipyrrole-3(2h)-carboxamide, (8as)-
  • 7-((1,6-dihydro-7-((4,5,8,8a-tetrahydro-7-methyl-4-oxocyclopropa(c)pyrrolo(3,2-e)indol-2(1h)-yl)carbonyl)benzo(1,2-b:4,3-b')dipyrrol-3(2h)-yl)carbonyl)-1,6-dihydrobenzo(1,2-b:4,3-b')dipyrrole-3(2h)-one
  • benzo(1,2-b:4,3-b')dipyrrole-3(2h)-carboxamide, 7-((1,6-dihydro-7-((4,5,8,8a-tetrahydro-7-methyl-4-oxacyclopropa(c)pyrrolo(3,2-e)indol-2(1h)-yl)carbonyl)benzo(1,2-b:4,3-b')dipyrrol-3(2h)-yl)carbonyl)-1,6-dihydro-, (8as)-
  • benzo(1,2-b:4,3-b')dipyrrole-3(2h)-carboxamide, 7-((1,6-dihydro-7-((4,5,8,8a-tetrahydro-7-methyl-4-oxocyclopropa(c)pyrrolo(3,2-e)indol-2(1h)-yl)carbonyl)benzo(1,2-b:4,3-b')dipyrrol-3(2h)-yl)carbonyl)-1,6-dihydro-, (7br)-
  • cpi-cdpi(2)
  • u 78057
CAS Number(s)
  • 114251-19-3
InChIKey SNYJVTXPSXNUSZ-FXTIPPFDSA-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