(8Xi,9Xi,13α,14Xi,17Xi,20S,24Xi)-Ergostane

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Formula C28H50
IUPAC Name (5r,8r,9s,10s,13r,14r,17s)-10,13-dimethyl-17-[(1s,4r)-1,4,5-trimethylhexyl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1h-cyclopenta[a]phenanthrene
Molecular Mass 386.697 g·mol−1
Heat of Formation -458.8 ± 16.7 kJ·mol−1
Dipole Moment 0.21 ± 1.08 D
Volume 557.3 Å 3
Surface Area 422.35 Å 2
HOMO Energy -9.84 ± 0.55 eV
LUMO Energy 6.63 ± eV
Point Group Symmetry C1
InChIKey WAAWMJYYKITCGF-RSBWKXGZSA-N
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Elements H C