(8S,9S,13S,14S,16R,17R)-13-Methyl-2,4-Dinitro-6,7,8,9,11,12,14,15,16,17-Decahydrocyclopenta[A]Phenanthrene-3,16,17-Triol

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Formula C18H22N2O7
IUPAC Name (8s,9s,13s,14s,16r,17r)-13-methyl-2,4-dinitro-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,16,17-triol
Molecular Mass 378.377 g·mol−1
Heat of Formation -573.5 ± 16.7 kJ·mol−1
Dipole Moment 4.94 ± 1.08 D
Volume 420.66 Å 3
Surface Area 345.12 Å 2
HOMO Energy -10.14 ± 0.55 eV
LUMO Energy -1.48 ± eV
Point Group Symmetry C1
InChIKey LLFZJKFNNKBCQE-OHDHRFJRSA-N
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