4-[(Z)-(3,5-Diamino-1H-Pyrazol-4-Yl)Diazenyl]Phenol

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Properties Simple | Detailed

Formula C9H10N6O
IUPAC Name 4-[(z)-(3,5-diaminopyrazol-1-ium-5-ylium-4-yl)azo]phenol
Molecular Mass 218.215 g·mol−1
Heat of Formation 285.4 ± 16.7 kJ·mol−1
Dipole Moment 2.88 ± 1.08 D
Volume 245.11 Å 3
Surface Area 230.88 Å 2
HOMO Energy -8.70 ± 0.55 eV
LUMO Energy 2.59 ± eV
Point Group Symmetry C1
InChIKey AYZRKFOEZQBUEA-SEYXRHQNSA-N
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