(7S,11Bs)-2-Methyl-7-Phenyl-1,3,4,6,7,11B-Hexahydro-2H-Pyrazino[2,1-A]Isoquinoline

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Formula C19H22N2
IUPAC Name (5s,7s,11bs)-2-methyl-7-phenyl-1,3,4,6,7,11b-hexahydropyrazino[2,1-a]isoquinoline
Molecular Mass 278.391 g·mol−1
Heat of Formation 239.5 ± 16.7 kJ·mol−1
Dipole Moment 0.81 ± 1.08 D
Volume 357.44 Å 3
Surface Area 303.84 Å 2
HOMO Energy -8.70 ± 0.55 eV
LUMO Energy 0.33 ± eV
Point Group Symmetry C1
Synonyms
  • (7s,11bs)-2-methyl-7-phenyl-1,3,4,6,7,11b-hexahydropyrazino[2,1-a]isoquinoline
  • 1,3,4,6,7,11b-hexahydro-2-methyl-7-phenyl-2h-pyrazino(2,1-a)isoquinoline
  • 2h-pyrazino(2,1-a)isoquinoline, 1,3,4,6,7,11b-hexahydro-2-methyl-7-phenyl-, trans
  • hmppiq
CAS Number(s)
  • 90065-35-3
InChIKey JWDCLQHNIUCQJT-RBUKOAKNSA-N
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