(3S,4Ar,5As,6As,6Bs,9R,9Ar,11As,11Br)-5-(1,3-Dioxo-1,3-Dihydro-2H-Isoindol-2-Yl)-9A,11B-Dimethyl-9-[(2R)-6-Methyl-2-Heptanyl]Hexadecahydro-2H-Cyclopenta[1,2]Phenanthro[8A,9-B]Aziren-3-Yl Acetate

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Formula C37H52N2O4
IUPAC Name (3s,4ar,5as,6as,6bs,9r,9ar,11as,11br)-5-(1,3-dioxo-1,3-dihydro-2h-isoindol-2-yl)-9a,11b-dimethyl-9-[(2r)-6-methyl-2-heptanyl]hexadecahydro-2h-cyclopenta[1,2]phenanthro[8a,9-b]aziren-3-yl acetate
Molecular Mass 588.820 g·mol−1
Heat of Formation 3596.7 ± 16.7 kJ·mol−1
Dipole Moment 6.85 ± 1.08 D
Volume 532.79 Å 3
Surface Area 461.39 Å 2
HOMO Energy -8.18 ± 0.55 eV
LUMO Energy -1.90 ± eV
Point Group Symmetry C1
InChIKey YPVNQSYTFZVXIY-SQMFSRLTSA-N
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