3,7,8,9-Tetrahydro-8-Hydroxy-1,3,7-Trimethyl-1H-Purine-2,6-Dione

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Properties Simple | Detailed

Formula C8H12N4O3++
IUPAC Name (7s,8r)-8-hydroxy-1,3,7-trimethyl-8,9-dihydropurine-2,6-dione
Molecular Mass 212.206 g·mol−1
Heat of Formation -435.0 ± 16.7 kJ·mol−1
Dipole Moment 3.64 ± 1.08 D
Volume 235.18 Å 3
Surface Area 219.65 Å 2
HOMO Energy -8.46 ± 0.55 eV
LUMO Energy -0.39 ± eV
Point Group Symmetry C1
InChIKey LSSRXYJELYKXQJ-SSDOTTSWSA-N
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