1-Tetradecylazepane 1-Oxide

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Properties Simple | Detailed

Formula C20H42NO+
IUPAC Name 1-oxido-1-tetradecyl-azepan-1-ium
Molecular Mass 312.554 g·mol−1
Heat of Formation -319.0 ± 16.7 kJ·mol−1
Dipole Moment 4.27 ± 1.08 D
Volume 458.94 Å 3
Surface Area 423.33 Å 2
HOMO Energy -8.48 ± 0.55 eV
LUMO Energy 1.62 ± eV
Point Group Symmetry C1
Synonyms
  • 1-myristyl-1-oxido-azepan-1-ium
  • 1-oxido-1-tetradecylazepan-1-ium
  • 1-tetradecylperhydroazepine n-oxide
  • 1h-azepine, hexahydro-1-tetradecyl-, 1-oxide
  • hexahydro-1-tetradecyl-1h-azepine 1-oxide
  • tphno-1
CAS Number(s)
  • 74493-23-5
InChIKey SBOMHBTVBXSCJT-UHFFFAOYSA-N
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