Formula |
C15H19Cl2N3O |
IUPAC Name |
(2s,3s)-1-(2,4-dichlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pentan-3-ol |
Molecular Mass |
328.237 g·mol−1 |
Heat of Formation |
-89.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.75 ± 1.08 D |
Volume |
377.83 Å 3 |
Surface Area |
307.9 Å 2 |
HOMO Energy |
-9.88 ± 0.55 eV |
LUMO Energy |
-0.78 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 1h-1,2,4-triazole-1-ethanol, beta-((2,4-dichlorophenyl)methyl)-alpha-(1,1-dimethylethyl)-, (alphas,betas)-
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CAS Number(s) |
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InChIKey |
URDNHJIVMYZFRT-UONOGXRCSA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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Elements |
H
C
N
O
Cl
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