(6S)-2-Amino-6-[(1R,2S)-1,2-Dihydroxypropyl]-6,7-Dihydro-1H-Pteridin-3-Ium-4-One

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Formula C9H13N5O3
IUPAC Name (6s)-2-amino-6-[(1r,2s)-1,2-dihydroxypropyl]-6,7-dihydro-1h-pteridin-3-ium-4-one
Molecular Mass 239.231 g·mol−1
Heat of Formation -294.6 ± 16.7 kJ·mol−1
Dipole Moment 6.06 ± 1.08 D
Volume 266.29 Å 3
Surface Area 245.92 Å 2
HOMO Energy -9.88 ± 0.55 eV
LUMO Energy -1.32 ± eV
Point Group Symmetry C1
InChIKey XFYMOOIPEIPRLU-YAPIXWNMSA-O
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