(8Xi,9Xi,10α,14Xi)-10-[(2S)-2-Oxiranyl]Estr-4-Ene-3,17-Dione

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Properties Simple | Detailed

Formula C20H26O3
IUPAC Name (8r,9s,10s,13s,14s)-13-methyl-10-[(2r)-oxiran-2-yl]-2,6,7,8,9,11,12,14,15,16-decahydro-1h-cyclopenta[a]phenanthrene-3,17-dione
Molecular Mass 314.419 g·mol−1
Heat of Formation -437.9 ± 16.7 kJ·mol−1
Dipole Moment 4.81 ± 1.08 D
Volume 388.82 Å 3
Surface Area 308.31 Å 2
HOMO Energy -9.90 ± 0.55 eV
LUMO Energy -0.20 ± eV
Point Group Symmetry C1
InChIKey JJEROASYJCSDIU-WKSOIMLMSA-N
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