(1S,2S,6R,7R,10S,12R,13R)-13-Hydroxy-6,13-Bis(Hydroxymethyl)-2,6-Dimethyltetracyclo[10.3.1.0~1,10~.0~2,7~]Hexadecan-5-One
Properties
Property | Value |
---|---|
Formula | C20H32O4 |
IUPAC Name | (1s,2s,6r,7r,10s,12r,13r)-13-hydroxy-6,13-bis(hydroxymethyl)-2,6-dimethyltetracyclo[10.3.1.0 1,10 .0 2,7 ]hexadecan-5-one |
Molecular Mass | 336.466 g·mol−1 |
Heat of Formation | -894.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.24 ± 1.08 D |
Volume | 411.91 Å 3 |
Surface Area | 315.59 Å 2 |
HOMO Energy | -9.82 ± 0.55 eV |
LUMO Energy | 0.79 ± eV |
Point Group Symmetry | C1 |
InChIKey | PCKFULMONJBMIR-OMAJZLRHSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |