Formula |
C27H18F4N4O3S |
IUPAC Name |
n-[7-cyano-6-[4-fluoro-3-[[2-[3-(trifluoromethyl)phenyl]acetyl]amino]phenoxy]-1,3-benzothiazol-2-yl]cyclopropanecarboxamide |
Molecular Mass |
554.515 g·mol−1 |
Heat of Formation |
-719.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.93 ± 1.08 D |
Volume |
592.93 Å 3 |
Surface Area |
525.47 Å 2 |
HOMO Energy |
-9.16 ± 0.55 eV |
LUMO Energy |
1.80 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
OJFKUJDRGJSAQB-UHFFFAOYSA-N |
QR Code |
Generate QR Code |
Links |
PubChem
ChemSpider
|
DOI |
|
Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
Elements |
C
F
H
O
N
S
|
|
|