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• W2890042782 abstract "Abstract Guanidinium chloride reacts with the superacidic solutions HF/MF 5 (M=As, Sb) at a molar ratio of 1:2 under formation of the diprotonated guanidinium salts [C(NH 2 ) 2 (NH 3 )][AsF 6 ] 2 and [C(NH 2 ) 2 (NH 3 )][SbF 6 ] 2 . The compounds were characterized by using infrared and Raman spectroscopy. Furthermore, single‐crystal X‐ray structure analysis of the guanidinium(2+) salts [C(NH 2 ) 2 (NH 3 )][SbF 6 ] 2 ⋅HF, [C(NH 2 ) 2 (NH 3 )] 2 [Ge 3 F 16 ]⋅HF, and [C(NH 2 ) 2 (NH 3 )] 2 [Ge 3 F 16 ]⋅2 HF and the guanidinium(1+) salt [C(NH 2 ) 3 ][SbF 6 ] is reported. The discussion of the experimental data is supported by quantum‐chemical calculations of the [C(NH 2 ) 2 (NH 3 )] 2+ and [C(NH 2 ) 3 ] + ions to investigate the modification of the resonance stabilization during the protonation process at the PBE1PBE/6–311G++(3df,3pd) level of theory. The planar CN 3 skeleton of the guanidinium(2+) ion has two carbon–nitrogen bonds in the range 1.286(4)–1.293(4) Å and one carbon–nitrogen bond of 1.453(4) Å, which can be explained with a decreased resonance stabilization relative to the guanidinium(1+) ion." @default.
• W2890042782 created "2018-09-27" @default.
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• W2890042782 date "2018-10-31" @default.
• W2890042782 modified "2023-10-18" @default.
• W2890042782 title "Diprotonation of Guanidine in Superacidic Solutions" @default.
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• W2890042782 doi "https://doi.org/10.1002/chem.201803726" @default.
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