(4Ar,5S,9Br)-1-Methyl-5-Phenyl-2,3,4,4A,5,9B-Hexahydro-1H-Indeno[1,2-B]Pyridine

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Formula C19H21N
IUPAC Name (1s,4ar,5s,9br)-1-methyl-5-phenyl-2,3,4,4a,5,9b-hexahydroindeno[1,2-b]pyridine
Molecular Mass 263.377 g·mol−1
Heat of Formation 191.4 ± 16.7 kJ·mol−1
Dipole Moment 1.93 ± 1.08 D
Volume 339.8 Å 3
Surface Area 289.49 Å 2
HOMO Energy -8.68 ± 0.55 eV
LUMO Energy 0.31 ± eV
Point Group Symmetry C1
Synonyms
  • (-)-1-methyl-5-phenyl-2,3,4,4a,5,9b-hexahydro-1h-indeno(1,2-b)pyridine
  • (-)-2,3,4,4a,5,9b-hexahydro-1-methyl-5-phenyl-1h-indeno(1,2-b)pyridine
  • (4ar,5s,9br)-1-methyl-5-phenyl-2,3,4,4a,5,9b-hexahydroindeno[1,2-b]pyridine
  • 1h-indeno(1,2-b)pyridine, 2,3,4,4a,5,9b-hexahydro-1-methyl-5-phenyl-, (-)-
  • 1h-indeno(1,2-b)pyridine, 2,3,4,4a,5,9b-hexahydro-1-methyl-5-phenyl-, (4a-alpha,5-alpha,9b-alpha)-
CAS Number(s)
  • 107035-08-5
  • 81202-76-8
InChIKey ZFTCDHKYTKCNGS-QYZOEREBSA-N
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