2,3,4,4A,7,8,12B,13-Octahydro-1H-6-Thia-13A-Azabenzo[F]Naphtho[1,2,3-Cd]Azulene
Properties
Property | Value |
---|---|
Formula | C19H21NS |
IUPAC Name | 2,3,4,4a,7,8,12b,13-octahydro-1h-6-thia-13a-azabenzo[f]naphtho[1,2,3-cd]azulene |
Molecular Mass | 295.442 g·mol−1 |
Heat of Formation | 179.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.13 ± 1.08 D |
Volume | 357.53 Å 3 |
Surface Area | 297.38 Å 2 |
HOMO Energy | -8.48 ± 0.55 eV |
LUMO Energy | 2.97 ± eV |
Point Group Symmetry | C1 |
InChIKey | UPLPXIWDTYNAMK-WBVHZDCISA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H S C N |