(3α,5Beta,7α,8α,10α,13α,15R)-3,15-Dibromo-7-Hydroxypimar-9(11)-En-16-Yl Hydrogen Sulfate

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Formula C20H32Br2O5S
IUPAC Name [(2r)-2-[(2s,4br,7r,8as,10r,10ar)-7-bromo-10-hydroxy-2,4b,8,8-tetramethyl-3,5,6,7,8a,9,10,10a-octahydro-1h-phenanthren-2-yl]-2-bromo-ethyl] hydrogen sulfate
Molecular Mass 544.338 g·mol−1
Heat of Formation -1071.4 ± 16.7 kJ·mol−1
Dipole Moment 4.34 ± 1.08 D
Volume 526.92 Å 3
Surface Area 399.37 Å 2
HOMO Energy -9.72 ± 0.55 eV
LUMO Energy -0.18 ± eV
Point Group Symmetry C1
InChIKey GRKSCRUIKNMSSP-GLVCTKENSA-N
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Elements C H S O Br