9,11,11-Trimethyl-2-Methylene-4-[(9,11,11-Trimethyl-3-Oxotricyclo[4.3.2.0~1,5~]Undec-2-Yl)Methyl]Tricyclo[4.3.2.0~1,5~]Undecan-3-One

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Properties Simple | Detailed

Formula C30H44O2
IUPAC Name alertenone
Molecular Mass 436.669 g·mol−1
Heat of Formation -189.3 ± 16.7 kJ·mol−1
Dipole Moment 3.06 ± 1.08 D
Volume 566.42 Å 3
Surface Area 418.41 Å 2
HOMO Energy -9.59 ± 0.55 eV
LUMO Energy 0.14 ± eV
Point Group Symmetry C1
InChIKey WYBSXJBCCDNLRE-VKXMSHHCSA-N
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