6-Ethoxy-9-[(2R,4Ar,6R,7R,7Ar)-7-Fluoro-2-Isopropoxy-7-Methyl-2-Oxidotetrahydro-4H-Furo[3,2-D][1,3,2]Dioxaphosphinin-6-Yl]-9H-Purin-2-Amine

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Properties Simple | Detailed

Formula C16H23FN5O6P
IUPAC Name 9-[(2r,4ar,6r,7r,7ar)-7-fluoro-2-isopropoxy-7-methyl-2-oxo-4,4a,6,7a-tetrahydrofuro[3,2-d][1,3,2]dioxaphosphinin-6-yl]-6-ethoxy-purin-9-ium-2-amine
Molecular Mass 431.356 g·mol−1
Heat of Formation -1295.8 ± 16.7 kJ·mol−1
Dipole Moment 4.39 ± 1.08 D
Volume 463.03 Å 3
Surface Area 389.45 Å 2
HOMO Energy -8.82 ± 0.55 eV
LUMO Energy 2.65 ± eV
Point Group Symmetry C1
InChIKey PVRFQJIRERYGTQ-MVXGGCNYSA-N
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Elements C F H O N P