1-(Hydroxymethyl)-3,7-Dimethyl-3,7-Dihydro-1H-Purine-2,6-Dione

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Formula C8H14N4O3
IUPAC Name 1-(hydroxymethyl)-3,7-dimethyl-8h-purine-4,5,8,9-tetraide-2,6-dione
Molecular Mass 214.222 g·mol−1
Heat of Formation -386.6 ± 16.7 kJ·mol−1
Dipole Moment 4.42 ± 1.08 D
Volume 226.8 Å 3
Surface Area 216.23 Å 2
HOMO Energy -9.14 ± 0.55 eV
LUMO Energy 2.39 ± eV
Point Group Symmetry C1
InChIKey NXGJWKRNZOULRN-UHFFFAOYSA-N
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