5-(1,3-Benzodioxol-5-Ylmethyl)[1,2,4]Triazolo[1,5-C]Quinazolin-2-Amine
Properties
Property | Value |
---|---|
Formula | C17H14N5O2+ |
IUPAC Name | 5-(1,3-benzodioxol-5-ylmethyl)-3h-[1,2,4]triazolo[1,5-c]quinazolin-4-ium-2-amine |
Molecular Mass | 320.325 g·mol−1 |
Heat of Formation | 254.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 1.17 ± 1.08 D |
Volume | 352.29 Å 3 |
Surface Area | 320.7 Å 2 |
HOMO Energy | -8.79 ± 0.55 eV |
LUMO Energy | 2.11 ± eV |
Point Group Symmetry | C1 |
InChIKey | GPDFQUXFCMBYJK-UHFFFAOYSA-O |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |