2-[(5R,8S,9S,10S,13R,14S,17R)-10,13-Dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-Tetradecahydro-1H-Cyclopenta[A]Phenanthren-17-Yl]Ethane-1,1,1-Triol
Properties
Property | Value |
---|---|
Formula | C21H36O3 |
IUPAC Name | 2-[(5r,8s,9s,10s,13r,14s,17r)-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1h-cyclopenta[a]phenanthren-17-yl]ethane-1,1,1-triol |
Molecular Mass | 336.509 g·mol−1 |
Heat of Formation | -898.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 0.71 ± 1.08 D |
Volume | 437.81 Å 3 |
Surface Area | 345.37 Å 2 |
HOMO Energy | -9.91 ± 0.55 eV |
LUMO Energy | 5.12 ± eV |
Point Group Symmetry | C1 |
InChIKey | IHLXICMZQRPJCC-LFGUEBOJSA-N |
QR Code | Generate QR Code |
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Elements | H C O |