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Infrared Photodissociation Spectroscopy of Ti+(CO2)2Ar and Ti+(CO2)n (n=3-7) Complexes 被引量:1
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作者 xiao-peng xing Guan-jun Wang +1 位作者 Cai-xia Wang Ming-fei Zhou 《Chinese Journal of Chemical Physics》 SCIE CAS CSCD 2013年第6期687-693,I0004,共8页
Ti+(CO2)2Ar and Ti+(CO2)n (n=3-7) complexes are produced by laser vaporization in a pulsed supersonic expansion. The ion complexes of interest are each mass-selected in a time- of-flight spectrometer, and stud... Ti+(CO2)2Ar and Ti+(CO2)n (n=3-7) complexes are produced by laser vaporization in a pulsed supersonic expansion. The ion complexes of interest are each mass-selected in a time- of-flight spectrometer, and studied with infrared photodissociation spectroscopy. For each complex, a sharp band in the CO stretching frequency region is observed, which confirms the formation of the OTi+CO(CO2)~_l oxide-carbonyl species. Small OTi+CO(CO2)~_1 complexes (n_〈5) exhibit CO stretching and antisymmetric CO2 stretching vibrational bands that are blue-shifted from those of free CO and CO2. The experimental observations indicate that the coordination number of CO and CO2 molecules around TiO+ is five. Evidence is also observed for the presence of another electrostatic bonding Ti+(CO2)2 structural isomer for the Ti+(CO2)2Ar complex, which is characterized to have a bent OCO-Ti+-OCO structure stabilized by argon coordination. 展开更多
关键词 Infrared photodissociation spectroscopy Carbon dioxide complex TITANIUM Insertion reaction Density functional calculation
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