4-[(5-Methyl-1H-Pyrazol-3-Yl)Amino]-2-Phenyl-1(2H)-Phthalazinone

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Properties Simple | Detailed

Formula C18H15N5O
IUPAC Name 4-[(5-methyl-1h-pyrazol-3-yl)amino]-2-phenyl-phthalazin-1-one
Molecular Mass 317.345 g·mol−1
Heat of Formation 400.1 ± 16.7 kJ·mol−1
Dipole Moment 3.29 ± 1.08 D
Volume 363.04 Å 3
Surface Area 327.97 Å 2
HOMO Energy -8.20 ± 0.55 eV
LUMO Energy 3.02 ± eV
Point Group Symmetry C1
InChIKey DSDIWWSXOOXFSI-UHFFFAOYSA-O
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