8-(Dicyclopropylmethyl)-1-(~11~C)Methyl-3-Propyl-3,7-Dihydro-1H-Purine-2,6-Dione

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Properties Simple | Detailed

Formula C16H23N4O2
IUPAC Name 8-(dicyclopropylmethyl)-1-methyl-3-propyl-7h-purin-9-ium-5-ide-2,6-dione
Molecular Mass 303.379 g·mol−1
Heat of Formation -126.1 ± 16.7 kJ·mol−1
Dipole Moment 4.16 ± 1.08 D
Volume 379.0 Å 3
Surface Area 335.52 Å 2
HOMO Energy -8.93 ± 0.55 eV
LUMO Energy 2.65 ± eV
Point Group Symmetry C1
Synonyms
  • 8-(dicyclopropylmethyl)-1-methyl-3-propyl-7h-purine-2,6-dione
  • 8-(dicyclopropylmethyl)-1-methyl-3-propyl-7h-purine-2,6-quinone
  • [1-methyl-11c]8-dicyclopropylmethyl-1-methyl-3-propylxanthine
  • [11c]mpdx
InChIKey RGDOXQAJXVTNRP-JVVVGQRLSA-N
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