5-[(2-Amino-[1,2,4]Triazolo[1,5-C]Quinazolin-4-Ium-6A-Ylium-5-Yl)Methyl]Benzene-1,3-Diol
Properties
Property | Value |
---|---|
Formula | C16H14N5O2+ |
IUPAC Name | 5-[(2-amino-3h-[1,2,4]triazolo[1,5-c]quinazolin-4-ium-5-yl)methyl]benzene-1,3-diol |
Molecular Mass | 308.315 g·mol−1 |
Heat of Formation | 129.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.44 ± 1.08 D |
Volume | 343.99 Å 3 |
Surface Area | 314.87 Å 2 |
HOMO Energy | -8.99 ± 0.55 eV |
LUMO Energy | 2.07 ± eV |
Point Group Symmetry | C1 |
InChIKey | BEMOFPJYLAELOK-UHFFFAOYSA-O |
QR Code | Generate QR Code |
Links | PubChem |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |