7-[(2R,4Ar,6R,7R,7Ar)-2,7-Dihydroxy-2-Oxo-4A,6,7,7A-Tetrahydro-4H-Furo[3,2-D][1,3,2]Dioxaphosphinin-6-Yl]-4-Amino-Pyrrolo[2,3-D]Pyrimidine-1,3-Diium-4A-Ide-5-Carboxamide

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Formula C12H14N5O7P
IUPAC Name 7-[(2r,4ar,6r,7r,7ar)-2,7-dihydroxy-2-oxo-4a,6,7,7a-tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-4-amino-pyrrolo[2,3-d]pyrimidine-1,3-diium-4a-ide-5-carboxamide
Molecular Mass 371.243 g·mol−1
Heat of Formation -1336.6 ± 16.7 kJ·mol−1
Dipole Moment 6.82 ± 1.08 D
Volume 369.49 Å 3
Surface Area 307.88 Å 2
HOMO Energy -8.55 ± 0.55 eV
LUMO Energy 2.54 ± eV
Point Group Symmetry C1
InChIKey DBWBUCANDDQUQR-GVYNHYCVSA-O
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