Crystal structure and Hirshfeld surface analysis of a supramolecular aggregate of 4-formyl-<i>N</i>,<i>N</i>-dimethylanilinium bromide with tetrabromomethane

The title compound, C<sub>9</sub>H<sub>12</sub>NO<sup>+</sup>·Br<sup>-</sup>·CBr<sub>4</sub>, consists of one 4-formyl-<i>N</i>,<i>N</i>-di-methyl-benzenaminium bromide and a tetra-bromo-methane mol-ecule. In the crystal, the bromide ions link 4-formyl-<i>N</i>,<i>N</i>-di-methyl-benzenaminium moieties through inter-molecular C-H⋯Br and N-H⋯Br hydrogen bonds, while inter-molecular C-H⋯O hydrogen bonds link 4-formyl-<i>N</i>,<i>N</i>-di-methyl-benzenaminium cations, enclosing <i>R</i> <sup>2</sup> <sub>2</sub>(18) ring motifs, into a di-periodic network structure. The tetra-bromo-methane mol-ecules fill the spaces between the layers. Neither π-π nor C-H⋯π(ring) inter-actions are observed. A Hirshfeld surface analysis of the crystal structure indicates that the most abundant contacts contributing to the crystal packing are from H⋯Br/Br⋯H (56.0%), Br⋯Br (12.1%), H⋯O/O⋯H (9.7%) and H⋯H (9.5%) inter-actions.

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Journal
Acta Crystallographica Section E Crystallographic Communications
Published
2025-08-04
DOI
https://doi.org/10.1107/s2056989025006929
Primary Topic
Crystal structures of chemical compounds
Type
article
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0.00

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article

Crystal structure and Hirshfeld surface analysis of a supramolecular aggregate of 4-formyl-N,N-dimethylanilinium bromide with tetrabromomethane

Atash V. Gurbanov, Alebel N. Belay, Tuncer Hökelek, Khudayar I. Hasanov et al.
Acta Crystallographica Section E Crystallographic Communications
Crystal structures of chemical compounds
article

Crystal structure and Hirshfeld surface analysis of a supramolecular aggregate of 4-formyl-N,N-dimethylanilinium bromide with tetrabromomethane

Atash V. Gurbanov, Alebel N. Belay, Tuncer Hökelek, Khudayar I. Hasanov, Gunay Z. Mammadova, Tahir A. Javadzade
article en

Abstract

The title compound, C<sub>9</sub>H<sub>12</sub>NO<sup>+</sup>·Br<sup>-</sup>·CBr<sub>4</sub>, consists of one 4-formyl-<i>N</i>,<i>N</i>-di-methyl-benzenaminium bromide and a tetra-bromo-methane mol-ecule. In the crystal, the bromide ions link 4-formyl-<i>N</i>,<i>N</i>-di-methyl-benzenaminium moieties through inter-molecular C-H⋯Br and N-H⋯Br hydrogen bonds, while inter-molecular C-H⋯O hydrogen bonds link 4-formyl-<i>N</i>,<i>N</i>-di-methyl-benzenaminium cations, enclosing <i>R</i> <sup>2</sup> <sub>2</sub>(18) ring motifs, into a di-periodic network structure. The tetra-bromo-methane mol-ecules fill the spaces between the layers. Neither π-π nor C-H⋯π(ring) inter-actions are observed. A Hirshfeld surface analysis of the crystal structure indicates that the most abundant contacts contributing to the crystal packing are from H⋯Br/Br⋯H (56.0%), Br⋯Br (12.1%), H⋯O/O⋯H (9.7%) and H⋯H (9.5%) inter-actions.

Acta Crystallographica Section E Crystallographic CommunicationsVol. 81(9)
Khazar University (AZ), Azerbaijan Medical University (AZ), Baku State University (AZ), Bahir Dar University (ET), Hacettepe University (TR)
Hacettepe Üniversitesi, Baki Dövlət Universiteti
Clean water and sanitation
Openalex Percentile: Top 84%
Crystal structures of chemical compounds
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Crystal structure and Hirshfeld surface analysis of a supramolecular aggregate of 4-formyl-<i>N</i>,<i>N</i>-dimethylanilinium bromide with tetrabromomethane — Atash V. Gurbanov, Alebel N. Belay, et al. · Acta Crystallographica Section E Crystallographic Communications (2025) | TGRS Research Map | TGRS