4-Chloro-2-Phenyl-2H-1,2,3-Triazole

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Properties Simple | Detailed

Formula C8H6ClN3
IUPAC Name 4-chloro-2-phenyl-blahcyclopenta-3,5-diene
Molecular Mass 179.606 g·mol−1
Heat of Formation 389.3 ± 16.7 kJ·mol−1
Dipole Moment 2.12 ± 1.08 D
Volume 187.87 Å 3
Surface Area 196.25 Å 2
HOMO Energy -9.42 ± 0.55 eV
LUMO Energy 2.02 ± eV
Point Group Symmetry Cs
InChIKey WCPZFNHDALKPPT-UHFFFAOYSA-N
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Elements H C N Cl