3-[(Dimethylcarbamoyl)Oxy]-2-{[(2,2-Diphenylpropanoyl)Oxy]Methyl}-1-(~11~C)Methylpyridinium

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Properties Simple | Detailed

Formula C25H27N2O4+
IUPAC Name [3-(dimethylcarbamoyloxy)-1-methylpyridin-1-ium-2-yl]methyl 2,2-diphenylpropanoate
Molecular Mass 418.494 g·mol−1
Heat of Formation 3905.4 ± 16.7 kJ·mol−1
Dipole Moment 5.95 ± 1.08 D
Volume 448.34 Å 3
Surface Area 385.92 Å 2
HOMO Energy -8.76 ± 0.55 eV
LUMO Energy -2.33 ± eV
Point Group Symmetry C1
Synonyms
  • [11c]mddp
  • n-[11c]methyl-3-[[(dimethylamino)carbonyl]oxy]-2-(2',2'-diphenylpropionoxymethyl)pyridinium
InChIKey WHIMEOMPXHBKBV-NUTRPMROSA-N
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