(2S,3R,5R,6S,10S,13S)-2,6-Dimethyl-8-Azahexacyclo[11.6.1.0~2,10~.0~3,8~.0~5,19~.0~16,20~]Icosa-1(20),16,18-Triene
Properties
Property | Value |
---|---|
Formula | C21H27N |
IUPAC Name | daphenylline |
Molecular Mass | 293.446 g·mol−1 |
Heat of Formation | 1.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 1.30 ± 1.08 D |
Volume | 370.43 Å 3 |
Surface Area | 292.51 Å 2 |
HOMO Energy | -8.40 ± 0.55 eV |
LUMO Energy | 0.56 ± eV |
Point Group Symmetry | C1 |
InChIKey | FRNKVSPOMBSICI-GFIDMXBQSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C N |