(11β,13Xi)-21-Hydroxy-11,18-Epoxypregn-4-Ene-3,20-Dione

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Properties Simple | Detailed

Formula C21H28O4
IUPAC Name (11beta,13xi)-21-hydroxy-11,18-epoxypregn-4-ene-3,20-dione
Molecular Mass 344.445 g·mol−1
Heat of Formation -725.2 ± 16.7 kJ·mol−1
Dipole Moment 5.28 ± 1.08 D
Volume 417.2 Å 3
Surface Area 332.86 Å 2
HOMO Energy -9.73 ± 0.55 eV
LUMO Energy 0.02 ± eV
Point Group Symmetry C1
InChIKey ZEBLTAXSHAKMDJ-SNCGNRLASA-N
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Elements H C O