Electron attachment to fluorodeoxyglucose: Dissociation dynamics in a molecule of near-zero electron affinity.
Eugene Arthur-BaidooMilan OnčákStephan DeniflPublished in: The Journal of chemical physics (2022)
Fluorodeoxyglucose (FDG) is a glucose derivative with fluorine at the C 2 position. The molecule containing the radioactive F-18 isotope is well known from its application in positron emission tomography as a radiotracer in tumor examination. In the stable form with the F-19 isotope, FDG was proposed as a potential radiosensitizer. Since reduction processes may be relevant in radiosensitization, we investigated low-energy electron attachment to FDG with a crossed electron-molecule beam experiment and with quantum chemical calculations as well as molecular dynamics at elevated temperatures to reveal statistical dissociation. We experimentally find that the susceptibility of FDG to low-energy electrons is relatively low. The calculations indicate that upon attachment of an electron with a kinetic energy of ∼0 eV, only dipole-bound states are accessible, which agrees with the weak ion yields observed in the experiment. The temporary negative ions formed upon electron attachment to FDG may decay by a large variety of dissociation reactions. The major fragmentation channels include H 2 O, HF, and H 2 dissociation, accompanied by ring opening.
Keyphrases
- positron emission tomography
- molecular dynamics
- electron transfer
- computed tomography
- pet imaging
- pet ct
- density functional theory
- electron microscopy
- solar cells
- molecular dynamics simulations
- heart failure
- skeletal muscle
- monte carlo
- type diabetes
- blood glucose
- gene expression
- mass spectrometry
- genome wide
- water soluble
- insulin resistance
- metabolic syndrome
- solid phase extraction