4-(2-Furylmethyl)-5-Methyl-2-Phenyl-2,4-Dihydro-3H-Pyrazol-3-One

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Properties Simple | Detailed

Formula C15H14N2O2
IUPAC Name (4r)-4-(2-furylmethyl)-5-methyl-2-phenyl-4h-pyrazol-3-one
Molecular Mass 254.284 g·mol−1
Heat of Formation 41.7 ± 16.7 kJ·mol−1
Dipole Moment 3.37 ± 1.08 D
Volume 303.38 Å 3
Surface Area 280.27 Å 2
HOMO Energy -8.62 ± 0.55 eV
LUMO Energy 2.89 ± eV
Point Group Symmetry C1
InChIKey OYPJOCYFBQAZFJ-CQSZACIVSA-N
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