Title of article :
Crystal structure and Hirshfeld surface analysis of (2E,2′E)-1,1′-[seleno­bis­­(4,1-phenyl­ene)]bis­­[3-(4-chloro­phen­yl)prop-2-en-1-one]
Author/Authors :
Bouraoui, Hazem Laboratoire de Cristallographie - Département de Physique - Université des Frères Mentouri-Constantine, Algeria , Mechehoud,Youcef Laboratoire VAREN - Département de Chimie - Faculté des Sciences Exactes - Université Mentouri-Constantine, 25000 Constantine, Algeria , Chetioui, Souheyla Chetiouid,e* Unité de Recherche de Chimie de l'Environnement et Moléculaire Structurale (CHEMS), Faculté des Sciences Exactes, Département de Chimie - Université des Frères Mentouri Constantine,Algeria , Touzani, Rachid Laboratoire de Chimie Appliquée et Environnement - Faculté des Sciences, Université Mohamed Premier, BP524, 60000, Oujda, Morocco , Medjani, Meriem Laboratoire de Cristallographie - Département de Physique - Université des Frères Mentouri-Constantine, Algeria , Benmilat, Ahmed Laboratoire de Cristallographie - Département de Physique - Université des Frères Mentouri-Constantine, Algeria , Boudjada, Ali Laboratoire de Cristallographie - Département de Physique - Université des Frères Mentouri-Constantine, Algeria
Pages :
11
From page :
1
To page :
11
Abstract :
In the title com­pound, C30H20Cl2O2Se, the C—Se—C angle is 99.0 (2)°, with the dihedral angle between the planes of the attached benzene rings being 79.1 (3)°. The average endocyclic angles (Se—C—C) facing the Se atom are 122.1 (5) and 122.2 (5)°. The Se atom is essentially coplanar with the attached benzene rings, deviating by 0.075 (1) and 0.091 (1) Å. In the two phenyl­ene(4-chloro­phen­yl)prop-2-en-1-one units, the benzene rings are inclined to each other by 44.6 (3) and 7.8 (3)°. In the crystal, the mol­ecules stack up the a axis, forming layers parallel to the ac plane. There are no significant classical inter­molecular inter­actions present. Hirshfeld surface analysis, two-dimensional fingerprint plots and the mol­ecular electrostatic potential surface were used to analyse the crystal packing. The Hirshfeld surface analysis suggests that the most significant contributions to the crystal packing are by C⋯H/H⋯C contacts (17.7%).
Keywords :
crystal structure , organoselenium , selenium , Hirshfeld surface analysis
Journal title :
Acta Crystallographica Section E: Crystallographic Communications
Serial Year :
2019
Full Text URL :
Record number :
2625054
Link To Document :
بازگشت