Formula |
C22H22ClN5O2 |
IUPAC Name |
n-[6-[1-(3-chloro-4-cyano-phenyl)-3,5-dimethyl-pyrazol-4-yl]oxy-3-pyridyl]-2,2-dimethyl-propanamide |
Molecular Mass |
423.895 g·mol−1 |
Heat of Formation |
91.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
11.03 ± 1.08 D |
Volume |
498.16 Å 3 |
Surface Area |
439.17 Å 2 |
HOMO Energy |
-8.79 ± 0.55 eV |
LUMO Energy |
-1.63 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
LIUZXHGDAOUZLO-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
O
Cl
|
|
|