N-Benzyl-2-{7-[2-(~18~F)Fluoroethyl]-8-Oxo-2-Phenyl-7,8-Dihydro-9H-Purin-9-Yl}-N-Methylacetamide

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Formula C23H23FN5O2
IUPAC Name n-benzyl-2-[7-(2-fluoroethyl)-8-oxo-2-phenyl-purine-1,3-diium-5-id-9-yl]-n-methyl-acetamide
Molecular Mass 420.459 g·mol−1
Heat of Formation -110.2 ± 16.7 kJ·mol−1
Dipole Moment 4.76 ± 1.08 D
Volume 496.03 Å 3
Surface Area 411.24 Å 2
HOMO Energy -9.04 ± 0.55 eV
LUMO Energy 2.02 ± eV
Point Group Symmetry C1
InChIKey QJZDLHWHIBNCJV-MIGPCILRSA-N
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