Halogen and hydrogen bonding in cis-dichlorobis(propionitrile)platinum(II) chloroform monosolvate
| Autor: | Margarita S. Avdontceva, Anastasiia Afanasenko, Tatiana G. Chulkova, Alexander S. Novikov |
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| Rok vydání: | 2016 |
| Předmět: |
Chloroform
Halogen bond 010405 organic chemistry Hydrogen bond chemistry.chemical_element 010402 general chemistry Condensed Matter Physics Photochemistry 01 natural sciences 0104 chemical sciences Inorganic Chemistry chemistry.chemical_compound chemistry Halogen Polymer chemistry General Materials Science Propionitrile Platinum |
| Zdroj: | Zeitschrift für Kristallographie - Crystalline Materials. 231:435-440 |
| ISSN: | 2196-7105 2194-4946 |
| Popis: | The weak intermolecular noncovalent interactions in the solvate cis-[PtCl2(C2H5CN)2]·CHCl3 were studied by XRD and DFT methods. Special attention was paid to a chloroform molecule as a potential donor of both hydrogen and halogen bonds. On the one hand, the H atom of chloroform links two Cl atoms of cis-[PtCl2(C2H5CN)2] (Hchloroform–Clcomplex (2.660 Å, 2.811 Å)), and on the other side, the weak Clchloroform–Clcomplex (3.247 and 3.497 Å) interactions were found. According to DFT calculation, only the Hchloroform–Clcomplex (2.660 and 2.811 Å) and Clchloroform–Clcomplex (3.247 Å) interactions can be classified as weak noncovalent bonds, whereas the contacts Clchloroform–Cnitrile (3.391 Å) and Clchloroform–Clcomplex (3.497 Å) are due to the crystal packing effect. |
| Databáze: | OpenAIRE |
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