(13α,16α)-16-Azido-3-Methoxyestra-1,3,5(10)-Trien-17-One

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Formula C19H23N3O2
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 325.405 g·mol−1
Heat of Formation -25.5 ± 16.7 kJ·mol−1
Dipole Moment 4.62 ± 1.08 D
Volume 396.47 Å 3
Surface Area 335.23 Å 2
HOMO Energy -8.78 ± 0.55 eV
LUMO Energy 2.86 ± eV
Point Group Symmetry C1
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InChIKey CHIQFWSFQDADKY-OGJJZOIMSA-N
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