(17β)-17-(Butylamino)Estra-1,3,5(10)-Trien-3-Ol

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Formula C22H33NO
IUPAC Name (8r,9r,13r,14s,17r)-17-(butylamino)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-ol
Molecular Mass 327.504 g·mol−1
Heat of Formation -290.0 ± 16.7 kJ·mol−1
Dipole Moment 1.71 ± 1.08 D
Volume 434.37 Å 3
Surface Area 358.57 Å 2
HOMO Energy -8.71 ± 0.55 eV
LUMO Energy 3.26 ± eV
Point Group Symmetry C1
InChIKey FSASUYCRSCVLGC-MLBCHFTJSA-N
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