(16α)-16-Azido-3-Methoxyestra-1,3,5(10)-Trien-17-One

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Properties Simple | Detailed

Formula C19H24N3O2
IUPAC Name (8r,9s,13r,14s,16r)-16-azido-3-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6h-cyclopenta[a]phenanthren-17-one
Molecular Mass 326.413 g·mol−1
Heat of Formation -21.1 ± 16.7 kJ·mol−1
Dipole Moment 4.97 ± 1.08 D
Volume 399.51 Å 3
Surface Area 337.56 Å 2
HOMO Energy -8.78 ± 0.55 eV
LUMO Energy 2.79 ± eV
Point Group Symmetry C1
InChIKey CHIQFWSFQDADKY-RXYDEIHYSA-N
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