(6R,8R)-8-Hydroxy-3-[(2R,4S,5R)-4-Hydroxy-5-(Hydroxymethyl)Tetrahydrofuran-2-Yl]-6-Methyl-4,6,7,8-Tetrahydropyrimido[1,2-A]Purin-1-Ium-3A-Id-10-One

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Properties Simple | Detailed

Formula C14H20N5O5
IUPAC Name (6r,8r)-8-hydroxy-3-[(2r,4s,5r)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-6-methyl-4,6,7,8-tetrahydropyrimido[1,2-a]purin-1-ium-3a-id-10-one
Molecular Mass 338.339 g·mol−1
Heat of Formation -673.9 ± 16.7 kJ·mol−1
Dipole Moment 5.85 ± 1.08 D
Volume 371.98 Å 3
Surface Area 327.45 Å 2
HOMO Energy -8.91 ± 0.55 eV
LUMO Energy -0.66 ± eV
Point Group Symmetry C1
InChIKey MBDJIUKVEXYOLQ-DOJUDFQASA-P
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