6-Methyl-3-[(5-Phenyl-2-Pentanyl)Oxy]-5,6,6A,7,8,9,10,10A-Octahydro-1,9-Phenanthridinediol
Properties
| Property | Value |
|---|---|
| Formula | C25H33NO3 |
| IUPAC Name | (6s,6ar,9r,10as)-6-methyl-3-[(1r)-1-methyl-4-phenyl-butoxy]-5,6,6a,7,8,9,10,10a-octahydrophenanthridine-1,9-diol |
| Molecular Mass | 395.534 g·mol−1 |
| Heat of Formation | -552.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.79 ± 1.08 D |
| Volume | 506.48 Å 3 |
| Surface Area | 413.24 Å 2 |
| HOMO Energy | -8.25 ± 0.55 eV |
| LUMO Energy | 0.21 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | YPYQDMBJZJZFQL-SQBPBYRNSA-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 |