(±)-Sculponeatin N

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Properties Simple | Detailed

Formula C20H28O4
IUPAC Name (1s,2'r,5r,6s,9r)-2'-(hydroxymethyl)-3',3'-dimethyl-10-methylene-spiro[3-oxatricyclo[7.2.1.01,6]dodecane-5,1'-cyclohexane]-2,11-dione
Molecular Mass 332.434 g·mol−1
Heat of Formation -717.0 ± 16.7 kJ·mol−1
Dipole Moment 6.20 ± 1.08 D
Volume 402.16 Å 3
Surface Area 312.43 Å 2
HOMO Energy -9.93 ± 0.55 eV
LUMO Energy -0.20 ± eV
Point Group Symmetry C1
InChIKey CRJKTSIXXJOHPU-PULXTJHUSA-N
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Elements H C O