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. 2024 Jul 3;15:797–807. doi: 10.3762/bjnano.15.66

Table 2.

Calculated threshold energies (in units of eV) of anionic fragments from the reaction Fe(CO)4(η2-C4H6O2) + e−.

m/z Ion Neutral fragments E th

254 Fe(CO)4(η2-C4H6O2)− — −1.35a
226 Fe(CO)3(η2-C4H6O2)− CO −1.40a
198 Fe(CO)2(η2-C4H6O2)− 2 × CO −0.02a
170 Fe(CO)(η2-C4H6O2)− 3 × CO 2.23
168 Fe(CO)4− (C4H6O2) −1.42a
142 Fe(η2-C4H6O2)− 4 × CO 4.35
142 Fe(CO)3H2− (C4H4O2), CO 2.08
140 Fe(CO)3− (C4H6O2), CO 0.36
127 Fe(CO)2CH3− (C3H3O2), 2 × CO 4.49
114 (C4H6O2)CO− Fe(CO)3 2.87
114 Fe(CO)OCH2− 3 × CO, C3H4O 3.44
114 Fe(CO)2H2− 2 × CO, (C4H4O2) 3.48
112 Fe(CO)2− 2 × CO, (C4H6O2) 3.39
86 C4H6O2− Fe(CO)4 1.29
84 Fe(CO)− 3 × CO, (C4H6O2) 5.00
56 Fe− 4 × CO, (C4H6O2) 7.68

aExothermic reaction.