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This study investigates the interaction between C20 and the cis-PtCl2(NH3)2 complex using MPW1PW91 quantum chemical calculations in gas and solution phases. Two interaction modes between C20 and the cis-PtCl2(NH3)2 complex are considered: I-isomer (η2-C20) and II-isomer (η1-C20). It also determines the effects of the solvent polarity on the dipole moment, electronic spatial extent (ESE), structural...
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