(3R,3Ar,5As,6S,9Ar,9Bs)-6-Butyl-3A,6-Dimethyl-3-[(2R)-6-Methyl-2-Heptanyl]Dodecahydro-1H-Cyclopenta[A]Naphthalene

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Properties Simple | Detailed

Formula C27H50
IUPAC Name (3r,3ar,5as,6r,9ar,9bs)-6-butyl-3-[(1s)-1,5-dimethylhexyl]-3a,6-dimethyl-2,3,4,5,5a,7,8,9,9a,9b-decahydro-1h-cyclopenta[a]naphthalene
Molecular Mass 374.686 g·mol−1
Heat of Formation -471.8 ± 16.7 kJ·mol−1
Dipole Moment 0.11 ± 1.08 D
Volume 554.39 Å 3
Surface Area 431.84 Å 2
HOMO Energy -9.86 ± 0.55 eV
LUMO Energy 3.64 ± eV
Point Group Symmetry C1
InChIKey JVEXQSVXUSNXKX-MZKJNLRRSA-N
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Elements H C