4-[(5Z)-4-Amino-5-(7-Methoxy-2H-Indol-2-Ylidene)-1,5-Dihydroimidazo[5,1-F][1,2,4]Triazin-7-Yl]Cyclohexanecarboxylic Acid
Properties
Property | Value |
---|---|
Formula | C21H22N6O3 |
IUPAC Name | 4-[(5z)-4-amino-5-(7-methoxyindol-2-ylidene)-1h-imidazo[5,1-f][1,2,4]triazin-7-yl]cyclohexanecarboxylic acid |
Molecular Mass | 406.438 g·mol−1 |
Heat of Formation | 2999.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 19.22 ± 1.08 D |
Volume | 445.68 Å 3 |
Surface Area | 401.31 Å 2 |
HOMO Energy | -9.46 ± 0.55 eV |
LUMO Energy | -3.80 ± eV |
Point Group Symmetry | C1 |
InChIKey | CDNMDRUIGNHEMR-FLKUCKMJSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | C O N |