9-{5-O-[(4-Amino-2-Ammonio-4-Oxobutanoyl)Sulfamoyl]Pentofuranosyl}-9H-Purin-6-Amine

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Properties Simple | Detailed

Formula C14H14N8O8S
IUPAC Name 9-{5-o-[(4-amino-2-ammonio-4-oxobutanoyl)sulfamoyl]pentofuranosyl}-9h-purin-6-amine
Molecular Mass 454.375 g·mol−1
Heat of Formation 906.8 ± 16.7 kJ·mol−1
Dipole Moment 4.27 ± 1.08 D
Volume 497.27 Å 3
Surface Area 439.52 Å 2
HOMO Energy -9.69 ± 0.55 eV
LUMO Energy -2.14 ± eV
Point Group Symmetry C1
InChIKey MOAVDHSPHZUJSX-UHFFFAOYSA-O
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