5-Hydroxy-2-[4-(1H-Tetrazol-5-Yl)Phenyl]-4(3H)-Pyrimidinone
Properties
Property | Value |
---|---|
Formula | C11H8N6O2 |
IUPAC Name | 5-hydroxy-2-[4-(1h-tetrazol-5-yl)phenyl]-4(3h)-pyrimidinone |
Molecular Mass | 256.220 g·mol−1 |
Heat of Formation | 227.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.36 ± 1.08 D |
Volume | 273.31 Å 3 |
Surface Area | 261.04 Å 2 |
HOMO Energy | -9.35 ± 0.55 eV |
LUMO Energy | 1.07 ± eV |
Point Group Symmetry | Cs |
InChIKey | PZUKKDSOBAHLMG-UHFFFAOYSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |