12,19-Dihydroxy-7-Methyleneabieta-8,11,13-Trien-3-One

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Properties Simple | Detailed

Formula C21H28O3
IUPAC Name (1s,4as,10ar)-6-hydroxy-1-(hydroxymethyl)-7-isopropyl-1,4a-dimethyl-9-methylene-3,4,10,10a-tetrahydrophenanthren-2-one
Molecular Mass 328.445 g·mol−1
Heat of Formation -568.2 ± 16.7 kJ·mol−1
Dipole Moment 2.14 ± 1.08 D
Volume 415.68 Å 3
Surface Area 338.31 Å 2
HOMO Energy -8.78 ± 0.55 eV
LUMO Energy -0.15 ± eV
Point Group Symmetry C1
InChIKey SPFNYVYVVBJTNF-HMXCVIKNSA-N
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Elements H C O