Literature DB >> 17249644

Are halide...halide contacts a feature of rock-salts only?

Yulia V Nelyubina1, Mikhail Yu Antipin, Konstantin A Lyssenko.   

Abstract

The electron density distribution function in the crystalline hydroxylammonium chloride obtained using the high-resolution X-ray diffraction technique was analyzed by means of Bader's "atoms in molecule" theory. The anion-anion interactions in the crystal of this ionic material were examined and the energy of the Cl-...Cl- contacts was estimated on the basis of the experimental data. The results obtained coincide well with the theoretical calculations and the X-ray diffraction data for the rock-salts. The existence of such type of interactions was shown to be not the unique feature of inorganic salts with point charge cations.

Entities:  

Year:  2007        PMID: 17249644     DOI: 10.1021/jp066049u

Source DB:  PubMed          Journal:  J Phys Chem A        ISSN: 1089-5639            Impact factor:   2.781


  5 in total

Review 1.  The Pnictogen Bond, Together with Other Non-Covalent Interactions, in the Rational Design of One-, Two- and Three-Dimensional Organic-Inorganic Hybrid Metal Halide Perovskite Semiconducting Materials, and Beyond.

Authors:  Arpita Varadwaj; Pradeep R Varadwaj; Helder M Marques; Koichi Yamashita
Journal:  Int J Mol Sci       Date:  2022-08-08       Impact factor: 6.208

2.  Diclofenac Ion Hydration: Experimental and Theoretical Search for Anion Pairs.

Authors:  Anastasia V Shishkina; Alexander A Ksenofontov; Nikita V Penkov; Mikhail V Vener
Journal:  Molecules       Date:  2022-05-23       Impact factor: 4.927

3.  Hydration of the Carboxylate Group in Anti-Inflammatory Drugs: ATR-IR and Computational Studies of Aqueous Solution of Sodium Diclofenac.

Authors:  Elena O Levina; Nikita V Penkov; Natalia N Rodionova; Sergey A Tarasov; Daria V Barykina; Mikhail V Vener
Journal:  ACS Omega       Date:  2018-01-10

4.  Synthesis, structure and in vitro antiproliferative effects of alkyne-linked 1,2,4-thiadiazole hybrids including erlotinib- and ferrocene-containing derivatives.

Authors:  Mohammed Boulhaoua; Tibor Pasinszki; Ana Torvisco; Rita Oláh-Szabó; Szilvia Bősze; Antal Csámpai
Journal:  RSC Adv       Date:  2021-08-25       Impact factor: 4.036

5.  Protonated nucleobases are not fully ionized in their chloride salt crystals and form metastable base pairs further stabilized by the surrounding anions.

Authors:  Prashant Kumar; Malgorzata Katarzyna Cabaj; Aleksandra Pazio; Paulina Maria Dominiak
Journal:  IUCrJ       Date:  2018-06-08       Impact factor: 4.769

  5 in total

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