N-(5-Cyclopropyl-1H-Pyrazol-3-Yl)Benzamide

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Properties Simple | Detailed

Formula C13H13N3O
IUPAC Name n-(5-cyclopropyl-1h-pyrazol-3-yl)benzamide
Molecular Mass 227.262 g·mol−1
Heat of Formation 216.6 ± 16.7 kJ·mol−1
Dipole Moment 5.39 ± 1.08 D
Volume 273.77 Å 3
Surface Area 265.85 Å 2
HOMO Energy -8.92 ± 0.55 eV
LUMO Energy 2.38 ± eV
Point Group Symmetry C1
Synonyms
  • 3-benzamidoaminopyrazole deriv. 4
  • n5b
InChIKey LUCORKWTQSQFFU-UHFFFAOYSA-N
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