1-(3-Methoxyphenyl)-N-(5-Methyl-1H-Pyrazol-3-Yl)-3-Isoquinolinamine

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Properties Simple | Detailed

Formula C20H18N4O
IUPAC Name 1-(3-methoxyphenyl)-n-(5-methyl-1h-pyrazol-3-yl)isoquinolin-3-amine
Molecular Mass 330.383 g·mol−1
Heat of Formation 319.1 ± 16.7 kJ·mol−1
Dipole Moment 3.39 ± 1.08 D
Volume 392.94 Å 3
Surface Area 353.57 Å 2
HOMO Energy -7.98 ± 0.55 eV
LUMO Energy 2.26 ± eV
Point Group Symmetry C1
Synonyms
  • [1-(3-methoxyphenyl)-3-isoquinolyl]-(5-methyl-1h-pyrazol-3-yl)amine
InChIKey IREPAVPIORVYOI-UHFFFAOYSA-N
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