(4S)-5-Methyl-2-Phenyl-4-[(E)-Phenyldiazenyl]-2,4-Dihydro-3H-Pyrazol-3-One

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Properties Simple | Detailed

Formula C16H14N4O
IUPAC Name (4s)-5-methyl-2-phenyl-4-[(e)-phenylazo]-4h-pyrazol-3-one
Molecular Mass 278.309 g·mol−1
Heat of Formation 406.1 ± 16.7 kJ·mol−1
Dipole Moment 3.74 ± 1.08 D
Volume 329.09 Å 3
Surface Area 310.63 Å 2
HOMO Energy -8.73 ± 0.55 eV
LUMO Energy 1.84 ± eV
Point Group Symmetry C1
InChIKey XCKGFJPFEHHHQA-HEWTWTGNSA-N
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