(8Xi,9Xi,10Xi,13Xi,14Xi)-17-Cyano-3-Oxoandrost-4-En-17-Yl Ethyl Carbonate

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Formula C23H31NO4
IUPAC Name [(8r,9s,10r,13s,14s,17s)-17-cyano-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1h-cyclopenta[a]phenanthren-17-yl] ethyl carbonate
Molecular Mass 385.497 g·mol−1
Heat of Formation -688.4 ± 16.7 kJ·mol−1
Dipole Moment 7.28 ± 1.08 D
Volume 476.63 Å 3
Surface Area 385.7 Å 2
HOMO Energy -9.82 ± 0.55 eV
LUMO Energy -0.06 ± eV
Point Group Symmetry C1
InChIKey ZVAOAJHHLVZEAV-PZCAJWILSA-N
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