[4-({4-[(5-Cyclopropyl-1H-Pyrazol-3-Yl)Amino]-2-Quinazolinyl}Imino)-2,5-Cyclohexadien-1-Yl]Acetonitrile
Properties
Property | Value |
---|---|
Formula | C22H19N7 |
IUPAC Name | 2-[4-[4-[(5-cyclopropyl-1h-pyrazol-3-yl)amino]quinazolin-2-yl]iminocyclohexa-2,5-dien-1-yl]acetonitrile |
Molecular Mass | 381.433 g·mol−1 |
Heat of Formation | 858.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.16 ± 1.08 D |
Volume | 465.59 Å 3 |
Surface Area | 388.75 Å 2 |
HOMO Energy | -8.65 ± 0.55 eV |
LUMO Energy | -0.95 ± eV |
Point Group Symmetry | C1 |
InChIKey | AWMNWCNUTIFHRJ-AEXIOTRNSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C N |