(5S,10R)-3-Isothiocyanato-5-Methyl-10,11-Dihydro-5H-5,10-Epiminodibenzo[A,D][7]Annulene
Properties
| Property | Value |
|---|---|
| Formula | C17H14N2S |
| IUPAC Name | (5s,10r)-3-isothiocyanato-5-methyl-10,11-dihydro-5h-5,10-epiminodibenzo[a,d][7]annulene |
| Molecular Mass | 278.371 g·mol−1 |
| Heat of Formation | 392.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.41 ± 1.08 D |
| Volume | 328.52 Å 3 |
| Surface Area | 295.68 Å 2 |
| HOMO Energy | -8.57 ± 0.55 eV |
| LUMO Energy | -0.85 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | IROZIFSXGAXYRY-IAGOWNOFSA-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 |