4-(3-Amino-1H-Pyrazol-4-Yl)Phenol

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Properties Simple | Detailed

Formula C9H9N3O
IUPAC Name 4-(5-amino-3h-pyrazol-2-ium-3-ylium-4-yl)phenol
Molecular Mass 175.187 g·mol−1
Heat of Formation 102.6 ± 16.7 kJ·mol−1
Dipole Moment 0.58 ± 1.08 D
Volume 204.16 Å 3
Surface Area 200.63 Å 2
HOMO Energy -8.44 ± 0.55 eV
LUMO Energy 3.00 ± eV
Point Group Symmetry C1
InChIKey WRERTDQKTDJJIZ-UHFFFAOYSA-N
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