Results 61 to 70 of about 449,459 (150)

1-(2,5-Dichloro-3-thienyl)ethanone: infinite sheets mediated by O...Cl halogen bonds

open access: yesActa Crystallographica Section E, 2010
In the title compound, C6H4Cl2OS, the acetyl group is almost coplanar with the thiophene ring [dihedral angle = 4.01 (2)°]. In the crystal, short intermolecular O...Cl contacts [2.9494 (14) and 3.1191 (14) 
A. N. Mayekar   +4 more
doaj   +1 more source

Halogen Bonds in Crystal Engineering: Like Hydrogen Bonds yet Different

open access: yes, 2014
CONSPECTUS: The halogen bond is an attractive interaction in which an electrophilic halogen atom approaches a negatively polarized species. Short halogen atom contacts in crystals have been known for around 50 years.
Mukherjee, Arijit   +2 more
core   +1 more source

Crystal structure of tetrabutylammonium bromide–1,2-diiodo-3,4,5,6-tetrafluorobenzene–dichloromethane (2/2/1)

open access: yesActa Crystallographica Section E: Crystallographic Communications, 2015
The crystallization of a 1:1 molar solution of 1,2-diiodo-3,4,5,6-tetrafluorobenzene (o-DITFB) and tetrabutylammonium bromide (n-Bu4NBr) from dichloromethane yielded pure white crystals of a halogen-bonded compound, C16H36N+·Br−·C6F4I2·0.5CH2Cl2 or [(n ...
Jasmine Viger-Gravel   +2 more
doaj   +1 more source

Halogen-Bond-Controlled Self-Assembly of Regioisomeric Phenanthridine Derivatives into Nanowires and Nanosheets

open access: yes, 2020
The spectroscopic and photophysical properties of organic materials in the films are widely influenced by their molecular packing morphologies and intermolecular interactions. Here, regioisomeric phenanthridine derivatives were synthesized.
Peng Pang (6312092)   +5 more
core   +1 more source

Halogen bonds in biological molecules.

open access: yes, 2004
Short oxygen-halogen interactions have been known in organic chemistry since the 1950s and recently have been exploited in the design of supramolecular assemblies. The present survey of protein and nucleic acid structures reveals similar halogen bonds as
Auffinger, Pascal   +3 more
core   +1 more source

Halogen Bonds: Benchmarks and Theoretical Analysis [PDF]

open access: yes, 2013
This article describes an extensive survey of wave function and DFT methods to test their accuracy on geometries and dissociation energies of halogen ...
Kozuch, Sebastian   +3 more
core   +1 more source

Strength, character, and directionality of halogen bonds involving cationic halogen bond donors

open access: yes, 2017
Halogen bonds involving cationic halogen bond donors and anionic halogen bond acceptors have recently been recognized as being important in stabilizing the crystal structures of many salts.
Khanh-An Tran, Kevin E. Riley
core   +1 more source

Noncovalent Interactions between 1,3,5-Trifluoro-2,4,6-triiodobenzene and a Series of 1,10-Phenanthroline Derivatives: A Combined Theoretical and Experimental Study

open access: yesCrystals, 2019
How many strong C−I⋯N halogen bonds can one 1,3,5-trifluoro-2,4,6-triiodobenzene molecule form in a crystal structure? To answer this question, we investigated in detail the noncovalent interactions between 1,3,5-trifluoro-2,4,6-triiodobenzene and ...
Yu Zhang, Jian-Ge Wang, Weizhou Wang
doaj   +1 more source

Visualizing Halogen Bonds in Planar Supramolecular Systems

open access: yes, 2016
Supramolecular interactions were studied in two planar model systems, 1,5- and 2,6-dibromoanthraquinones, prepared on Au(111) using scanning tunneling microscopy.
Howon Kim (1419361)   +5 more
core   +1 more source

Structural Competition between Hydrogen Bonds and Halogen Bonds

open access: yes, 2016
The molecules presented here provide a test-bed for competitive supramolecular chemistry, and on the basis of five crystal structures a ranking of the relative structural importance and influence of competing weak/strong hydrogen bonds and weak/strong ...
Meg Fasulo (2162293)   +4 more
core   +2 more sources

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