(6β)-6-(2-Pentyn-1-Yloxy)Androsta-1,4-Diene-3,17-Dione

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Properties Simple | Detailed

Formula C24H30O3
IUPAC Name (6r,8r,9s,10r,13s,14s)-10,13-dimethyl-6-pent-2-ynoxy-7,8,9,11,12,14,15,16-octahydro-6h-cyclopenta[a]phenanthrene-3,17-dione
Molecular Mass 366.493 g·mol−1
Heat of Formation -290.6 ± 16.7 kJ·mol−1
Dipole Moment 4.35 ± 1.08 D
Volume 466.14 Å 3
Surface Area 379.65 Å 2
HOMO Energy -9.80 ± 0.55 eV
LUMO Energy 2.40 ± eV
Point Group Symmetry C1
InChIKey VZGAHAQWKVTWEF-RAPVPNNWSA-N
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Elements H C O