5-[(3-Pyridinylmethyl)Amino]-1H-Pyrazole-4-Carboxamide

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Properties Simple | Detailed

Formula C10H11N5O
IUPAC Name 5-(3-pyridylmethylamino)-1h-pyrazole-4-carboxamide
Molecular Mass 217.227 g·mol−1
Heat of Formation 137.7 ± 16.7 kJ·mol−1
Dipole Moment 3.31 ± 1.08 D
Volume 252.95 Å 3
Surface Area 243.21 Å 2
HOMO Energy -9.04 ± 0.55 eV
LUMO Energy -0.89 ± eV
Point Group Symmetry C1
Synonyms
  • 3-(3-pyridylmethylamino)-2h-pyrazole-4-carboxamide
  • 3-(pyridin-3-ylmethylamino)-2h-pyrazole-4-carboxamide
  • zero/008395
InChIKey LBLVYSJDBWSBHZ-UHFFFAOYSA-N
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