Xorphanol
Properties
Property | Value |
---|---|
Formula | C23H31NO |
IUPAC Name | (1r,9r,10r,11s)-17-(cyclobutylmethyl)-11-methyl-13-methylene-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-4-ol |
Molecular Mass | 337.498 g·mol−1 |
Heat of Formation | -112.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 0.84 ± 1.08 D |
Volume | 440.53 Å 3 |
Surface Area | 351.79 Å 2 |
HOMO Energy | -8.53 ± 0.55 eV |
LUMO Energy | 3.17 ± eV |
Point Group Symmetry | C1 |
InChIKey | AZJPPZHRNFQRRE-HKDUHGGJSA-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 |