2,5,5-Trimethyl-1-Pyrroline N-Oxide

Molecule SVG Image

Properties Simple | Detailed

Formula C7H14NO+
IUPAC Name 2,2,5-trimethyl-1-oxido-3,4-dihydropyrrol-1-ium
Molecular Mass 128.192 g·mol−1
Heat of Formation -87.9 ± 16.7 kJ·mol−1
Dipole Moment 3.88 ± 1.08 D
Volume 175.19 Å 3
Surface Area 171.1 Å 2
HOMO Energy -8.43 ± 0.55 eV
LUMO Energy 3.91 ± eV
Point Group Symmetry Cs
Synonyms
  • 2,2,5-trimethyl-1-oxido-1-pyrrolin-1-ium
  • 3,4-dihydro-2,2,5-trimethyl-2h-pyrrole 1-oxide
CAS Number(s)
  • 4567-18-4
InChIKey QGNOEKXMUHRRJA-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N