5-(3-Aminopropyl)-3-(2,5-Difluorophenyl)-N-Ethyl-5-Phenyl-4,5-Dihydro-1H-Pyrazole-1-Carboxamide

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Properties Simple | Detailed

Formula C21H24F2N4O
IUPAC Name (5s)-5-(3-aminopropyl)-3-(2,5-difluorophenyl)-n-ethyl-5-phenyl-4h-pyrazole-1-carboxamide
Molecular Mass 386.438 g·mol−1
Heat of Formation -281.8 ± 16.7 kJ·mol−1
Dipole Moment 3.10 ± 1.08 D
Volume 463.48 Å 3
Surface Area 390.86 Å 2
HOMO Energy -9.04 ± 0.55 eV
LUMO Energy 2.13 ± eV
Point Group Symmetry C1
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InChIKey OQMVLDZJPRSNOG-NRFANRHFSA-N
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