2,5-Dibutyl-4-{[2'-(2H-Tetrazol-5-Yl)-4-Biphenylyl]Methyl}-2,4-Dihydro-3H-1,2,4-Triazol-3-One
Properties
Property | Value |
---|---|
Formula | C24H29N7O |
IUPAC Name | 2,5-dibutyl-4-[[4-[2-(2h-tetrazol-5-yl)phenyl]phenyl]methyl]-1,2,4-triazol-3-one |
Molecular Mass | 431.533 g·mol−1 |
Heat of Formation | 292.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.21 ± 1.08 D |
Volume | 534.38 Å 3 |
Surface Area | 399.69 Å 2 |
HOMO Energy | -9.11 ± 0.55 eV |
LUMO Energy | -0.74 ± eV |
Point Group Symmetry | C1 |
Synonyms |
|
CAS Number(s) |
|
InChIKey | STODEQQYGGTXOS-UHFFFAOYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |