6-Amino-1-[(2R,3R,4S,5R)-3,4-Dihydroxy-5-(Hydroxymethyl)Tetrahydrofuran-2-Yl]-4-Oxo-Pyrazolo[3,4-D]Pyrimidine-1,2,5,7-Tetraium-3-Carboxylic Acid

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Formula C11H15N5O7
IUPAC Name 6-amino-1-[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-4-oxo-pyrazolo[3,4-d]pyrimidine-1,2,5,7-tetraium-3-carboxylic acid
Molecular Mass 329.266 g·mol−1
Heat of Formation -871.6 ± 16.7 kJ·mol−1
Dipole Moment 7.75 ± 1.08 D
Volume 333.0 Å 3
Surface Area 292.37 Å 2
HOMO Energy -9.53 ± 0.55 eV
LUMO Energy -1.59 ± eV
Point Group Symmetry C1
InChIKey YDQZOMIOAHKZMB-ZHAMBMQHSA-O
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