(1R,3As,3Br,5As,10As,10Bs,12As)-1,10A,12A-Trimethyl-1,2,3,3A,3B,4,5,5A,6,7,10,10A,10B,11,12,12A-Hexadecahydrocyclopenta[5,6]Naphtho[1,2-F]Indazol-1-Ol
Properties
Property | Value |
---|---|
Formula | C21H32N2O |
IUPAC Name | (1r,3as,3br,5as,10as,10bs,12as)-1,10a,12a-trimethyl-1,2,3,3a,3b,4,5,5a,6,7,10,10a,10b,11,12,12a-hexadecahydrocyclopenta[5,6]naphtho[1,2-f]indazol-1-ol |
Molecular Mass | 328.492 g·mol−1 |
Heat of Formation | -241.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.21 ± 1.08 D |
Volume | 423.01 Å 3 |
Surface Area | 331.81 Å 2 |
HOMO Energy | -9.09 ± 0.55 eV |
LUMO Energy | 0.84 ± eV |
Point Group Symmetry | C1 |
InChIKey | LKAJKIOFIWVMDJ-GVQHXQKQSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |