5-Methoxy-3-(1-Phenyl-1H-Pyrazol-5-Yl)-1-[3-(Trifluoromethyl)Phenyl]-4(1H)-Pyridazinone

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Properties Simple | Detailed

Formula C21H15F3N4O2
IUPAC Name 5-methoxy-3-(2-phenylpyrazol-3-yl)-1-[3-(trifluoromethyl)phenyl]pyridazin-4-one
Molecular Mass 412.365 g·mol−1
Heat of Formation -303.2 ± 16.7 kJ·mol−1
Dipole Moment 6.41 ± 1.08 D
Volume 444.48 Å 3
Surface Area 362.99 Å 2
HOMO Energy -8.59 ± 0.55 eV
LUMO Energy 1.61 ± eV
Point Group Symmetry C1
InChIKey GZYJHHIEGNWBCR-UHFFFAOYSA-N
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