3-[4-(3,6-Dihydro-4-Phenyl-1(2H)-Pyridinyl)Butyl]-1H-Indol-5-Ol

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Properties Simple | Detailed

Formula C23H26N2O
IUPAC Name 3-[4-[(1s)-4-phenyl-3,6-dihydro-2h-pyridin-1-yl]butyl]indol-1-ium-5-ol
Molecular Mass 346.465 g·mol−1
Heat of Formation 92.9 ± 16.7 kJ·mol−1
Dipole Moment 1.96 ± 1.08 D
Volume 442.43 Å 3
Surface Area 400.44 Å 2
HOMO Energy -8.35 ± 0.55 eV
LUMO Energy -0.20 ± eV
Point Group Symmetry C1
Synonyms
  • 3-(4-(3,6-dihydro-4-phenyl-1(2h)-pyridinyl)butyl)-1h-indol-5-ol
  • 3-[4-(4-phenyl-3,6-dihydro-2h-pyridin-1-yl)butyl]-1h-indol-5-ol
  • pdsp1_001392
  • pdsp2_001376
  • tocris-1559
CAS Number(s)
  • 112192-04-8
InChIKey HGEYJZMMUGWEOT-UHFFFAOYSA-N
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