Methyl (15α,19E)-3-Oxovobasan-17-Oate

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Formula C21H24N2O3
IUPAC Name methyl (15alpha,19e)-3-oxovobasan-17-oate
Molecular Mass 352.427 g·mol−1
Heat of Formation -237.0 ± 16.7 kJ·mol−1
Dipole Moment 3.46 ± 1.08 D
Volume 423.99 Å 3
Surface Area 352.49 Å 2
HOMO Energy -8.70 ± 0.55 eV
LUMO Energy -0.61 ± eV
Point Group Symmetry C1
InChIKey TYPMTMPLTVSOBU-VQTPNMTRSA-N
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