Warning: Undefined array key "mm" in /www/wwwroot/www.ai-bt.com/si.php on line 10 Deprecated: trim(): Passing null to parameter #1 ($string) of type string is deprecated in /www/wwwroot/www.ai-bt.com/si.php on line 10 Crystallographic and Theoretical Evidences of Anion⋅⋅⋅Anion Interaction.

Literature DB >> 33719162

Crystallographic and Theoretical Evidences of Anion⋅⋅⋅Anion Interaction.

Rafał Wysokiński¹, Wiktor Zierkiewicz¹, Mariusz Michalczyk¹, Steve Scheiner².

Abstract

Planar (HgCl3 )- anions are stacked fairly closely together in a slipped parallel arrangement within several crystal structures. Quantum chemical analysis shows evidence of strong noncovalent spodium bonds between the Hg π-hole of one unit and the Cl atom of an adjacent unit. Anion⋅⋅⋅anion spodium bonds work in tandem with crystal packing forces.

Entities: Chemical

Keywords: electrostatic potential; energy decomposition; noncovalent interactions; solvent effects; π-hole

Year: 2021 PMID： 33719162 DOI： 10.1002/cphc.202100132

Source DB: PubMed Journal: Chemphyschem ISSN： 1439-4235 Impact factor: 3.102

Keyword Cloud
Cited

5 in total

1. 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

2. Insight into Spodium-π Bonding Characteristics of the MX₂⋯π (M = Zn, Cd and Hg; X = Cl, Br and I) Complexes-A Theoretical Study.

Authors: Meng Gao; Qibo Zhao; Hao Yu; Min Fu; Qingzhong Li
Journal: Molecules Date: 2022-04-30 Impact factor: 4.927

Crystallographic and Theoretical Evidences of Anion⋅⋅⋅Anion Interaction.

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

2. Insight into Spodium-π Bonding Characteristics of the MX₂⋯π (M = Zn, Cd and Hg; X = Cl, Br and I) Complexes-A Theoretical Study.

3. The Role of Hydrogen Bonds in Interactions between [PdCl₄]^2- Dianions in Crystal.

4. Anion⋅⋅⋅Anion Interactions Involving σ-Holes of Perrhenate, Pertechnetate and Permanganate Anions.

5. Anti-Electrostatic Pi-Hole Bonding: How Covalency Conquers Coulombics.

Crystallographic and Theoretical Evidences of Anion⋅⋅⋅Anion Interaction.

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

2. Insight into Spodium-π Bonding Characteristics of the MX2⋯π (M = Zn, Cd and Hg; X = Cl, Br and I) Complexes-A Theoretical Study.

3. The Role of Hydrogen Bonds in Interactions between [PdCl4]2- Dianions in Crystal.

4. Anion⋅⋅⋅Anion Interactions Involving σ-Holes of Perrhenate, Pertechnetate and Permanganate Anions.

5. Anti-Electrostatic Pi-Hole Bonding: How Covalency Conquers Coulombics.

2. Insight into Spodium-π Bonding Characteristics of the MX₂⋯π (M = Zn, Cd and Hg; X = Cl, Br and I) Complexes-A Theoretical Study.

3. The Role of Hydrogen Bonds in Interactions between [PdCl₄]^2- Dianions in Crystal.