2-(3-Methoxyphenyl)-5,6-Dihydro[1,2,4]Triazolo[5,1-A]Isoquinoline

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Properties Simple | Detailed

Formula C17H15N3O
IUPAC Name 2-(3-methoxyphenyl)-5,6-dihydro-[1,2,4]triazolo[5,1-a]isoquinoline
Molecular Mass 277.321 g·mol−1
Heat of Formation 261.1 ± 16.7 kJ·mol−1
Dipole Moment 2.98 ± 1.08 D
Volume 325.79 Å 3
Surface Area 303.35 Å 2
HOMO Energy -8.71 ± 0.55 eV
LUMO Energy -0.61 ± eV
Point Group Symmetry C1
Synonyms
  • (1,2,4)triazolo(5,1-a)isoquinoline, 5,6-dihydro-2-(3-methoxyphenyl)-
  • 2-(3-methoxyphenyl)-5,6-dihydro-s-triazolo(5,1-a)isoquinoline
  • 2-(m-methoxyphenyl)-5,6-dihydro-s-triazolo(5,1-a)isoquinoline
  • [1,2,4]triazolo[5,1-a]isoquinoline, 5,6-dihydro-2-(3-methoxyphenyl)-
  • l 10503
  • l-10503
  • s-triazolo(5,1-a)isoquinoline, 5,6-dihydro-2-(m-methoxyphenyl)-
CAS Number(s)
  • 55308-37-7
InChIKey OITUZFHSDXLWBR-UHFFFAOYSA-N
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