(6Z)-6-(1,3-Benzothiazol-2(3H)-Ylidene)-3-(Diethylamino)-2,4-Cyclohexadien-1-One
Properties
Property | Value |
---|---|
Formula | C17H18N2OS |
IUPAC Name | (6e)-6-(1,3-benzothiazol-2-ylidene)-3-(diethylamino)cyclohexa-2,4-dien-1-one |
Molecular Mass | 298.403 g·mol−1 |
Heat of Formation | 52.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.80 ± 1.08 D |
Volume | 353.5 Å 3 |
Surface Area | 319.67 Å 2 |
HOMO Energy | -8.05 ± 0.55 eV |
LUMO Energy | 1.99 ± eV |
Point Group Symmetry | C1 |
InChIKey | UJQMOFRKYMLMFK-GHRIWEEISA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H S C O N |