19,21-Dinorchola-1,3,5(10)-Trien-17-Ol, 3-(Cyclopentyloxy)-, (17α)-

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Properties Simple | Detailed

Formula C27H40O2
IUPAC Name (8r,9s,13s,14s,17r)-17-butyl-3-(cyclopentoxy)-13-methyl-7,8,9,11,12,14,15,16-octahydro-6h-cyclopenta[a]phenanthren-17-ol
Molecular Mass 396.605 g·mol−1
Heat of Formation -553.0 ± 16.7 kJ·mol−1
Dipole Moment 1.73 ± 1.08 D
Volume 519.11 Å 3
Surface Area 434.28 Å 2
HOMO Energy -8.44 ± 0.55 eV
LUMO Energy 0.50 ± eV
Point Group Symmetry C1
InChIKey RZJYCJNNICMHOJ-IONQDRQYSA-N
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Elements H C O