8-Butyl-1-Methyl-7-(2-Methylphenyl)-1H-Imidazo[2,1-F]Purine-2,4(3H,8H)-Dione

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Formula C19H27N5O2
IUPAC Name 6-butyl-4-methyl-7-(o-tolyl)-8h-purino[7,8-a]imidazole-4a,5,5a,7,8,9a-hexaide-1,3-dione
Molecular Mass 357.450 g·mol−1
Heat of Formation -59.2 ± 16.7 kJ·mol−1
Dipole Moment 7.98 ± 1.08 D
Volume 418.58 Å 3
Surface Area 359.79 Å 2
HOMO Energy -8.67 ± 0.55 eV
LUMO Energy 2.46 ± eV
Point Group Symmetry C1
InChIKey KCEWOOVCWCPFCY-UHFFFAOYSA-N
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