Homarine

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Properties Simple | Detailed

Formula C7H7NO2
IUPAC Name 1-methylpyridin-1-ium-2-carboxylate
Molecular Mass 137.136 g·mol−1
Heat of Formation -136.5 ± 16.7 kJ·mol−1
Dipole Moment 9.89 ± 1.08 D
Volume 160.29 Å 3
Surface Area 162.12 Å 2
HOMO Energy -9.74 ± 0.55 eV
LUMO Energy -1.73 ± eV
Point Group Symmetry Cs
Synonyms
  • 1-methyl-2-pyridin-1-iumcarboxylate
  • 1-methyl-2-pyridinecarboxylic acid
  • picolinic acid n-methylbetaine
CAS Number(s)
  • 445-30-7
InChIKey BRTLKRNVNFIOPJ-UHFFFAOYSA-N
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DOI
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