6-Chlorocholest-7-En-3-Yl Benzoate

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Formula C34H49ClO2
IUPAC Name [(3s,5r,6s,9r,10r,13r,14r,17r)-6-chloro-17-[(1r,5s)-1,5-dimethylhexyl]-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1h-cyclopenta[a]phenanthren-3-yl] benzoate
Molecular Mass 525.205 g·mol−1
Heat of Formation 1404.3 ± 16.7 kJ·mol−1
Dipole Moment 75.81 ± 1.08 D
Volume 675.09 Å 3
Surface Area 517.96 Å 2
HOMO Energy -5.47 ± 0.55 eV
LUMO Energy -5.42 ± eV
Point Group Symmetry C1
InChIKey UKWQLUBQPDACSU-OBLXBKGGSA-N
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Elements H C O Cl