1,5-Diazabicyclo(4.3.0)Non-5-Ene

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Properties Simple | Detailed

Formula C7H12N2
IUPAC Name 2,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrimidine
Molecular Mass 124.184 g·mol−1
Heat of Formation 36.3 ± 16.7 kJ·mol−1
Dipole Moment 3.26 ± 1.08 D
Volume 162.86 Å 3
Surface Area 164.23 Å 2
HOMO Energy -8.70 ± 0.55 eV
LUMO Energy 4.38 ± eV
Point Group Symmetry C1
Synonyms
  • 1,5-diazabicyclo[4.3.0]non-5-ene
  • 1,5-diazobicyclo(4.3.0)non-5-ene
  • pyrrolo[1,2-a]pyrimidine, 2,3,4,6,7,8-hexahydro-
CAS Number(s)
  • 3001-72-7
InChIKey SGUVLZREKBPKCE-UHFFFAOYSA-N
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