4-(4-Phenoxy-1H-Pyrazol-3-Yl)-1,3-Benzenediol

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Properties Simple | Detailed

Formula C15H12N2O3
IUPAC Name 4-(4-phenoxy-3h-pyrazol-2-ium-3-ylium-5-yl)benzene-1,3-diol
Molecular Mass 268.267 g·mol−1
Heat of Formation -129.5 ± 16.7 kJ·mol−1
Dipole Moment 2.88 ± 1.08 D
Volume 305.83 Å 3
Surface Area 266.19 Å 2
HOMO Energy -8.70 ± 0.55 eV
LUMO Energy 2.76 ± eV
Point Group Symmetry C1
InChIKey WUNNLMRNOJZGQB-UHFFFAOYSA-N
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