4-Amino-7-Hydroxy-8-[(Phosphonooxy)Methyl]-6A,7,8,9A-Tetrahydro-5H-Furo[2',3':4,5][1,3]Thiazolo[3,2-E]Purin-10-Ium

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Formula C10H12N5O6PS
IUPAC Name 4-amino-7-hydroxy-8-[(phosphonooxy)methyl]-6a,7,8,9a-tetrahydro-5h-furo[2',3':4,5][1,3]thiazolo[3,2-e]purin-10-ium
Molecular Mass 361.271 g·mol−1
Heat of Formation -123.6 ± 16.7 kJ·mol−1
Dipole Moment 9.47 ± 1.08 D
Volume 327.86 Å 3
Surface Area 306.97 Å 2
HOMO Energy -9.09 ± 0.55 eV
LUMO Energy -4.30 ± eV
Point Group Symmetry C1
InChIKey KXNOODWJWKDBCR-FULWYAMNSA-O
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