4-[(5S)-5-(4-Methoxyphenyl)-3-Phenyl-4,5-Dihydro-1H-Pyrazol-1-Yl]Benzenesulfonamide

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Properties Simple | Detailed

Formula C22H21N3O3S
IUPAC Name 4-[(3s)-3-(4-methoxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]benzenesulfonamide
Molecular Mass 407.485 g·mol−1
Heat of Formation -48.4 ± 16.7 kJ·mol−1
Dipole Moment 8.33 ± 1.08 D
Volume 469.0 Å 3
Surface Area 401.07 Å 2
HOMO Energy -8.54 ± 0.55 eV
LUMO Energy -1.08 ± eV
Point Group Symmetry C1
Synonyms
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InChIKey QBNZBMVRFYREHK-QFIPXVFZSA-N
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