(6Ar,10E,11As,11Br)-10-(1-Aminoethylidene)-7,7-Dimethyl-6A,7,11A,11B-Tetrahydro-6H-Pyrrolo[1',2':2,3]Isoindolo[4,5,6-Cd]Indole-9,11(2H,10H)-Dione

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Formula C20H21N3O2
IUPAC Name (6ar,10e,11as,11br)-10-(1-aminoethylidene)-7,7-dimethyl-6a,7,11a,11b-tetrahydro-6h-pyrrolo[1',2':2,3]isoindolo[4,5,6-cd]indole-9,11(2h,10h)-dione
Molecular Mass 335.400 g·mol−1
Heat of Formation -185.6 ± 16.7 kJ·mol−1
Dipole Moment 4.42 ± 1.08 D
Volume 388.36 Å 3
Surface Area 325.33 Å 2
HOMO Energy -8.26 ± 0.55 eV
LUMO Energy -0.14 ± eV
Point Group Symmetry C1
Synonyms
  • 6h-pyrrolo(1',2':2,3)isoindolo(4,5,6-cd)indole-9,11(2h,10h)-dione, 10-(1-aminoethylidene)-6a,7,11a,11b-tetrahydro-7,7-dimethyl-, (6aalpha,10e,11abeta,11balpha)-
CAS Number(s)
  • 31008-94-3
  • 31008-95-4
InChIKey AFOUSJMOYMLOPA-CIGIFLASSA-N
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