[(2S,3S,4S,5S)-5-(6-Amino-8-Azido-Purine-1,3,7-Triium-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl 4-Fluorosulfonylbenzoate

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Formula C17H16FN8O7S
IUPAC Name [(2s,3s,4s,5s)-5-(6-amino-8-azido-purine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl 4-fluorosulfonylbenzoate
Molecular Mass 495.422 g·mol−1
Heat of Formation -690.2 ± 16.7 kJ·mol−1
Dipole Moment 7.71 ± 1.08 D
Volume 500.16 Å 3
Surface Area 425.39 Å 2
HOMO Energy -9.09 ± 0.55 eV
LUMO Energy -1.33 ± eV
Point Group Symmetry C1
InChIKey OUZBOWGRZDKZSS-LIBKGXAOSA-O
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