(1S,9R)-10-[(2S)-2-(Benzyloxy)Propyl]-1,13,13-Trimethyl-10-Azatricyclo[7.3.1.0~2,7~]Trideca-2,4,6-Trien-6-Ol
Properties
Property | Value |
---|---|
Formula | C25H33NO2 |
IUPAC Name | crobenetine |
Molecular Mass | 379.535 g·mol−1 |
Heat of Formation | -311.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.33 ± 1.08 D |
Volume | 488.44 Å 3 |
Surface Area | 359.18 Å 2 |
HOMO Energy | -8.51 ± 0.55 eV |
LUMO Energy | 0.03 ± eV |
Point Group Symmetry | C1 |
InChIKey | VCCBCXVFGHTDQN-UODBTFMRSA-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 |