7-Chloro-8A-Isocyano-5,5,8,11,11-Pentamethyl-8-Vinyl-1,5,5A,6,7,8,8A,11-Octahydro-8Bh-1-Azacyclohepta[Mno]Aceanthrylen-8B-Ol
Properties
| Property | Value |
|---|---|
| Formula | C26H29ClN2O |
| IUPAC Name | 7-chloro-8a-isocyano-5,5,8,11,11-pentamethyl-8-vinyl-1,5,5a,6,7,8,8a,11-octahydro-8bh-1-azacyclohepta[mno]aceanthrylen-8b-ol |
| Molecular Mass | 420.974 g·mol−1 |
| Heat of Formation | 113.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.68 ± 1.08 D |
| Volume | 505.43 Å 3 |
| Surface Area | 374.76 Å 2 |
| HOMO Energy | -8.50 ± 0.55 eV |
| LUMO Energy | 2.93 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | RSUTYZFOFIAHFY-OWINPNOJSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C N O Cl |