5-(2,3-Dichlorophenyl)-N-(4-Pyridinylmethyl)Pyrazolo[1,5-A]Pyrimidin-7-Amine

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Formula C18H14Cl2N5+
IUPAC Name 5-(2,3-dichlorophenyl)-n-(4-pyridylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine
Molecular Mass 371.243 g·mol−1
Heat of Formation 535.9 ± 16.7 kJ·mol−1
Dipole Moment 5.66 ± 1.08 D
Volume 397.12 Å 3
Surface Area 359.79 Å 2
HOMO Energy -8.71 ± 0.55 eV
LUMO Energy -1.37 ± eV
Point Group Symmetry Cs
Synonyms
  • 5-(2,3-dichlorophenyl)-n-(4-pyridylmethyl)-7-pyrazolo[5,1-b]pyrimidinamine
  • 5-(2,3-dichlorophenyl)-n-(4-pyridylmethyl)pyrazolo[5,1-b]pyrimidin-7-amine
  • [5-(2,3-dichlorophenyl)pyrazolo[5,1-b]pyrimidin-7-yl]-(4-pyridylmethyl)amine
InChIKey CVYWYUAQFJMLEO-UHFFFAOYSA-N
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Elements H C Cl N