Crystal structure of <i>catena</i>-poly[bis(<i>N</i>,<i>O</i>-dimethylhydroxylammonium) [di-μ-bromido-dibromidostannate(II)]]

The title compound, {(C<sub>2</sub>H<sub>8</sub>NO)<sub>2</sub>[SnBr<sub>4</sub>]} <sub><i>n</i></sub> , is a layered hybrid perovskite crystallizing in the monoclinic space group <i>C</i>2/<i>c</i>. The asymmetric unit consists of one H<sub>3</sub>C-O-NH<sub>2</sub> <sup>+</sup>-CH<sub>3</sub> cation (Me<sub>2</sub>HA<sup>+</sup>), one Sn<sup>II</sup> atom located on a twofold rotation axis, and two Br atoms. The Sn<sup>II</sup> atom has a distorted octa-hedral coordination environment formed by the bromido ligands. The {SnBr<sub>6</sub>} units corner-share their equatorial Br atoms, forming infinite mono-layers that extend parallel to the <i>ab</i> plane. These inorganic layers are sandwiched by the organic Me<sub>2</sub>HA<sup>+</sup> cations organized in double-layers; stacking of the layers is along the <i>c-</i>axis direction. Consecutive inorganic layers, separated by the organic cations, are shifted relative to each other along the <i>b</i>-axis direction. Specifically, the Sn<sup>II</sup> atom in one inorganic layer is offset by 3.148 Å along the <i>b</i> axis relative to the Sn<sup>II</sup> atom in an adjacent inorganic layer. The <i>N</i>,<i>O</i>-di-methyl-hydroxyl-ammonium cation forms two hydrogen bonds with the axial bromide anions of the inorganic layers as acceptors, and leads to the cohesion of the crystal structure. According to Hirshfeld surface analysis, the highest contributions to the crystal packing are from H⋯H (46.2%), Br⋯H (38.5%), and H⋯O (14.8%) contacts.

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Journal
Acta Crystallographica Section E Crystallographic Communications
Published
2024-12-13
DOI
https://doi.org/10.1107/s2056989024012027
Citations
1
Primary Topic
Polyoxometalates: Synthesis and Applications
Type
article
Field-Weighted Citation Impact
0.12

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article

Crystal structure of catena-poly[bis(N,O-dimethylhydroxylammonium) [di-μ-bromido-dibromidostannate(II)]]

Irina A. Golenya, Valerii Y. Sirenko, Mircea-Odin Apostu, Sofiia V. Partsevska et al.
1 citations
Acta Crystallographica Section E Crystallographic Communications
Polyoxometalates: Synthesis and Applications
0.12
article

Crystal structure of catena-poly[bis(N,O-dimethylhydroxylammonium) [di-μ-bromido-dibromidostannate(II)]]

Irina A. Golenya, Valerii Y. Sirenko, Mircea-Odin Apostu, Sofiia V. Partsevska, Діна Д. Наумова
article en
1 citations

Abstract

The title compound, {(C<sub>2</sub>H<sub>8</sub>NO)<sub>2</sub>[SnBr<sub>4</sub>]} <sub><i>n</i></sub> , is a layered hybrid perovskite crystallizing in the monoclinic space group <i>C</i>2/<i>c</i>. The asymmetric unit consists of one H<sub>3</sub>C-O-NH<sub>2</sub> <sup>+</sup>-CH<sub>3</sub> cation (Me<sub>2</sub>HA<sup>+</sup>), one Sn<sup>II</sup> atom located on a twofold rotation axis, and two Br atoms. The Sn<sup>II</sup> atom has a distorted octa-hedral coordination environment formed by the bromido ligands. The {SnBr<sub>6</sub>} units corner-share their equatorial Br atoms, forming infinite mono-layers that extend parallel to the <i>ab</i> plane. These inorganic layers are sandwiched by the organic Me<sub>2</sub>HA<sup>+</sup> cations organized in double-layers; stacking of the layers is along the <i>c-</i>axis direction. Consecutive inorganic layers, separated by the organic cations, are shifted relative to each other along the <i>b</i>-axis direction. Specifically, the Sn<sup>II</sup> atom in one inorganic layer is offset by 3.148 Å along the <i>b</i> axis relative to the Sn<sup>II</sup> atom in an adjacent inorganic layer. The <i>N</i>,<i>O</i>-di-methyl-hydroxyl-ammonium cation forms two hydrogen bonds with the axial bromide anions of the inorganic layers as acceptors, and leads to the cohesion of the crystal structure. According to Hirshfeld surface analysis, the highest contributions to the crystal packing are from H⋯H (46.2%), Br⋯H (38.5%), and H⋯O (14.8%) contacts.

Acta Crystallographica Section E Crystallographic CommunicationsVol. 81(1)
Alexandru Ioan Cuza University (RO), Taras Shevchenko National University of Kyiv (UA)
Ministry of Education and Science of Ukraine
Openalex Percentile: Top 57%
Polyoxometalates: Synthesis and Applications
0.12
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