7-Methyl-6-(2-Sulfoethylamino)-9H-Purine-1,3-Diium-5-Id-8-One

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Properties Simple | Detailed

Formula C8H14N5O4S
IUPAC Name 7-methyl-6-(2-sulfoethylamino)-9h-purine-1,3-diium-5-id-8-one
Molecular Mass 276.293 g·mol−1
Heat of Formation -509.4 ± 16.7 kJ·mol−1
Dipole Moment 4.43 ± 1.08 D
Volume 283.22 Å 3
Surface Area 264.5 Å 2
HOMO Energy -9.03 ± 0.55 eV
LUMO Energy -1.04 ± eV
Point Group Symmetry C1
InChIKey TUTRXGWUYYOQPA-UHFFFAOYSA-O
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