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Properties Simple | Detailed

Formula C6H12N2O
IUPAC Name 1-nitrosoazepane
Molecular Mass 128.172 g·mol−1
Heat of Formation -38.8 ± 16.7 kJ·mol−1
Dipole Moment 4.29 ± 1.08 D
Volume 164.96 Å 3
Surface Area 160.59 Å 2
HOMO Energy -9.38 ± 0.55 eV
LUMO Energy 3.68 ± eV
Point Group Symmetry C1
Synonyms
  • 1h-azepine, hexahydro-1-nitroso-
  • hexahydro-1-nitroso-1h-azepine
  • hexahydro-1-nitrosoazepine
  • n-6-mi
  • n-nitrosoazacycloheptane
  • n-nitrosohexahydroazepine
  • n-nitrosohexamethyleneimine
  • n-nitrosohexamethylenimine
  • n-nitrosoperhydroazepine
  • nitrosohexamethyleneimine
  • nitrosohexamethylenimine
CAS Number(s)
  • 932-83-2
InChIKey UZMVSVHUTOAPTD-UHFFFAOYSA-N
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