(2S)-2-Amino-4-[{[(2S,3S,4R,5R)-5-(6-Amino-8-Azido-9H-Purin-9-Yl)-3,4-Dihydroxytetrahydro-2-Furanyl]Methyl}(Methyl)Sulfonio]Butanoate

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Properties Simple | Detailed

Formula C15H11N9O5S
IUPAC Name [6-amino-9-[(2r)-5-[[2-cyanoethynyl(methylene)-λ4-sulfanyl]methyl]-3,4-dioxo-tetrahydrofuran-2-yl]-2h-purin-7-ium-8-yl]imino-imino-ammonium; carbon dioxide
Molecular Mass 429.370 g·mol−1
Heat of Formation 1740.1 ± 16.7 kJ·mol−1
Dipole Moment 7.74 ± 1.08 D
Volume 435.72 Å 3
Surface Area 408.27 Å 2
Point Group Symmetry C1
InChIKey KIYVEMOJCNSOBL-NFDYBXBPSA-O
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