Formula |
C21H18ClN3OS |
IUPAC Name |
n-[2-(3-chlorophenyl)ethyl]-3-(p-tolyl)-6h-imidazo[2,1-b]thiazol-4-ium-6-ylium-5-carboxamide |
Molecular Mass |
395.905 g·mol−1 |
Heat of Formation |
191.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.21 ± 1.08 D |
Volume |
465.3 Å 3 |
Surface Area |
392.03 Å 2 |
HOMO Energy |
-8.79 ± 0.55 eV |
LUMO Energy |
-0.83 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
XLEXBEMTJAGGPY-UHFFFAOYSA-N |
QR Code |
Generate QR Code |
Links |
PubChem
ChemSpider
|
DOI |
|
Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
Elements |
C
Cl
H
O
N
S
|
|
|