(7β,11β,13Alpha)-7-Hydroxy-9,11-Epoxybeyer-15-En-17-Yl 4-Bromobenzoate

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Properties Simple | Detailed

Formula C27H33BrO4
IUPAC Name (7beta,11beta,13alpha)-7-hydroxy-9,11-epoxybeyer-15-en-17-yl 4-bromobenzoate
Molecular Mass 501.453 g·mol−1
Heat of Formation -517.6 ± 16.7 kJ·mol−1
Dipole Moment 4.39 ± 1.08 D
Volume 548.91 Å 3
Surface Area 427.21 Å 2
HOMO Energy -9.45 ± 0.55 eV
LUMO Energy -0.82 ± eV
Point Group Symmetry C1
InChIKey XRJFRXRBPQBNOI-FDVYTHAISA-N
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Elements H C O Br