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Ionic dissociation dynamics and energetics of hexamethyldigermanium, (CH3)6Ge2, by threshold photoelectron-photoion coincidence spectroscopy

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Abstract Threshold Photoelectron-Photoion Coincidence Spectroscopy (TPEPICO) has been used to study the ionic dissociation dynamics and energetics of Me 6 Ge 2 (Me = CH 3 ). Ions are energy-selected and the… Click to show full abstract

Abstract Threshold Photoelectron-Photoion Coincidence Spectroscopy (TPEPICO) has been used to study the ionic dissociation dynamics and energetics of Me 6 Ge 2 (Me = CH 3 ). Ions are energy-selected and the 0 K dissociation onsets for methyl and Me 3 Ge loss are obtained from the breakdown diagram and mass spectra distributions, both of them analyzed and modeled with statistical SSACM theory and quantum chemical (DFT, MP2) calculations. An updated value for the enthalpy of formation, Δ f H m 0 (g) of Me 6 Ge 2 , is used to derive Δ f H m 0 ( Me 3 Ge ,g) = 70.8 ± 8.9 kJ·mol −1 . The bond dissociation enthalpies, BDE (Ge X), of Me 3 Ge X (X = Me, GeMe 3 , Cl and Br) were also derived in this study.

Keywords: photoion coincidence; dissociation; threshold photoelectron; coincidence spectroscopy; photoelectron photoion; spectroscopy

Journal Title: Chemical Physics Letters
Year Published: 2017

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