6-Chloro-7-[5,6-Dimethyl-2-(1,3-Thiazol-2-Yl)-1H-Benzimidazol-1-Yl]-2,4-Quinazolinediamine
Properties
Property | Value |
---|---|
Formula | C20H16ClN7S |
IUPAC Name | 6-chloro-7-(5,6-dimethyl-2-thiazol-2-yl-benzimidazol-1-ium-1-yl)quinazoline-2,4-diamine |
Molecular Mass | 421.906 g·mol−1 |
Heat of Formation | 512.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.55 ± 1.08 D |
Volume | 456.95 Å 3 |
Surface Area | 391.83 Å 2 |
HOMO Energy | -8.57 ± 0.55 eV |
LUMO Energy | 0.87 ± eV |
Point Group Symmetry | C1 |
InChIKey | WSVACSSBUCFLCD-UHFFFAOYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C N S Cl |