Cp-93,129

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Formula C12H13N3O
IUPAC Name 3-(1,2,3,6-tetrahydropyridin-4-yl)-2,4,6,7-tetrahydro-1h-pyrrolo[3,2-b]pyridine-2,3,3a,6,7,7a-hexaid-5-one
Molecular Mass 215.251 g·mol−1
Heat of Formation 59.8 ± 16.7 kJ·mol−1
Dipole Moment 4.91 ± 1.08 D
Volume 253.63 Å 3
Surface Area 239.06 Å 2
HOMO Energy -8.56 ± 0.55 eV
LUMO Energy 2.41 ± eV
Point Group Symmetry C1
Synonyms
  • 3-(1,2,3,6-tetrahydropyridin-4-yl)-1,4-dihydropyrrolo[2,3-e]pyridin-5-one
  • 3-(1,2,5,6-tetrahydropyrid-4-yl)pyrrolo(3,2-b)pyrid-5-one
  • 5h-pyrrolo(3,2-b)pyridin-5-one, 1,4-dihydro-3-(1,2,3,6-tetrahydro-4-pyridinyl)-
  • cp 93129
  • pdsp1_000796
  • pdsp2_000784
  • tocris-1032
CAS Number(s)
  • 127792-75-0
InChIKey PJYVGMRFPFNZCT-UHFFFAOYSA-N
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