4,4'-(1H-1,2,3-Triazole-1,5-Diyl)Diphenol
Properties
Property | Value |
---|---|
Formula | C14H11N3O2 |
IUPAC Name | 4-[3-(4-hydroxyphenyl)-2-aza-3-azonia-1-azanidacyclopenta-2,4-dien-4-yl]phenol |
Molecular Mass | 253.256 g·mol−1 |
Heat of Formation | 95.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.86 ± 1.08 D |
Volume | 292.36 Å 3 |
Surface Area | 263.53 Å 2 |
HOMO Energy | -9.30 ± 0.55 eV |
LUMO Energy | 2.28 ± eV |
Point Group Symmetry | C1 |
InChIKey | VJAKQEJLSICLIC-UHFFFAOYSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
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Elements | H C O N |