(3β,9β,20R,22R,23S,25R)-14,15,16,17-Tetradehydroveratraman-3,23-Diol
Properties
Property | Value |
---|---|
Formula | C27H39NO2 |
IUPAC Name | (2s,3r,5s)-2-[(1s)-1-[(3s,6ar,11ar,11br)-3-hydroxy-10,11b-dimethyl-1,2,3,4,6,6a,11,11a-octahydrobenzo[a]fluoren-9-yl]ethyl]-5-methyl-piperidin-3-ol |
Molecular Mass | 409.604 g·mol−1 |
Heat of Formation | -452.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.76 ± 1.08 D |
Volume | 528.11 Å 3 |
Surface Area | 419.93 Å 2 |
HOMO Energy | -8.74 ± 0.55 eV |
LUMO Energy | 3.67 ± eV |
Point Group Symmetry | C1 |
InChIKey | MALFODICFSIXPO-WEQJUJCRSA-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 |