Bacteriohopanetetrol
Properties
Property | Value |
---|---|
Formula | C35H62O4 |
IUPAC Name | (2s,3r,4r,7r)-7-[(3r,3as,5ar,5br,7as,11as,11br,13ar,13bs)-5a,5b,8,8,11a,13b-hexamethyl-1,2,3,3a,4,5,6,7,7a,9,10,11,11b,12,13,13a-hexadecahydrocyclopenta[a]chrysen-3-yl]octane-1,2,3,4-tetrol |
Molecular Mass | 546.864 g·mol−1 |
Heat of Formation | -1179.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 1.19 ± 1.08 D |
Volume | 721.29 Å 3 |
Surface Area | 535.97 Å 2 |
HOMO Energy | -9.61 ± 0.55 eV |
LUMO Energy | 1.89 ± eV |
Point Group Symmetry | C1 |
InChIKey | JMKBTQYGOKJMBJ-ZQPPIKFSSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |