Cargando…
Crystal structure of bromido-fac-tricarbonyl[5-phenyl-3-(pyridin-2-yl)-1H-1,2,4-triazole-κ(2) N,N′]rhenium(I)
In the title compound, [ReBr(C(13)H(10)N(4))(CO)(3)], the Re(I) atom has a distorted octahedral coordination environment. Two N atoms of the 5-phenyl-3-(pyridin-2-yl)-1H-1,2,4-triazole ligand and two of the three carbonyl groups occupy the equatorial plane of the complex, with the third carbonyl li...
Autores principales: | , , |
---|---|
Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2014
|
Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4257395/ https://www.ncbi.nlm.nih.gov/pubmed/25552999 http://dx.doi.org/10.1107/S1600536814025604 |
_version_ | 1782347741646553088 |
---|---|
author | Piletska, Kseniia Domasevitch, Konstantin V. Shtemenko, Alexander V. |
author_facet | Piletska, Kseniia Domasevitch, Konstantin V. Shtemenko, Alexander V. |
author_sort | Piletska, Kseniia |
collection | PubMed |
description | In the title compound, [ReBr(C(13)H(10)N(4))(CO)(3)], the Re(I) atom has a distorted octahedral coordination environment. Two N atoms of the 5-phenyl-3-(pyridin-2-yl)-1H-1,2,4-triazole ligand and two of the three carbonyl groups occupy the equatorial plane of the complex, with the third carbonyl ligand and the bromide ligand in the axial positions. The three carbonyl ligands are arranged in a fac configuration around the Re(I) atom. Mutual N—H⋯Br hydrogen bonds arrange molecules into centrosymmetric dimers. Additional stabilization within the crystal structure is provided by C—H⋯O and C—H⋯Br hydrogen bonds, as well as by slipped π–π stacking interactions [centroid-to-centroid distance = 3.785 (5) Å], defining a three-dimensional network. |
format | Online Article Text |
id | pubmed-4257395 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2014 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-42573952014-12-31 Crystal structure of bromido-fac-tricarbonyl[5-phenyl-3-(pyridin-2-yl)-1H-1,2,4-triazole-κ(2) N,N′]rhenium(I) Piletska, Kseniia Domasevitch, Konstantin V. Shtemenko, Alexander V. Acta Crystallogr Sect E Struct Rep Online Research Communications In the title compound, [ReBr(C(13)H(10)N(4))(CO)(3)], the Re(I) atom has a distorted octahedral coordination environment. Two N atoms of the 5-phenyl-3-(pyridin-2-yl)-1H-1,2,4-triazole ligand and two of the three carbonyl groups occupy the equatorial plane of the complex, with the third carbonyl ligand and the bromide ligand in the axial positions. The three carbonyl ligands are arranged in a fac configuration around the Re(I) atom. Mutual N—H⋯Br hydrogen bonds arrange molecules into centrosymmetric dimers. Additional stabilization within the crystal structure is provided by C—H⋯O and C—H⋯Br hydrogen bonds, as well as by slipped π–π stacking interactions [centroid-to-centroid distance = 3.785 (5) Å], defining a three-dimensional network. International Union of Crystallography 2014-11-29 /pmc/articles/PMC4257395/ /pubmed/25552999 http://dx.doi.org/10.1107/S1600536814025604 Text en © Piletska et al. 2014 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited. |
spellingShingle | Research Communications Piletska, Kseniia Domasevitch, Konstantin V. Shtemenko, Alexander V. Crystal structure of bromido-fac-tricarbonyl[5-phenyl-3-(pyridin-2-yl)-1H-1,2,4-triazole-κ(2) N,N′]rhenium(I) |
title | Crystal structure of bromido-fac-tricarbonyl[5-phenyl-3-(pyridin-2-yl)-1H-1,2,4-triazole-κ(2)
N,N′]rhenium(I) |
title_full | Crystal structure of bromido-fac-tricarbonyl[5-phenyl-3-(pyridin-2-yl)-1H-1,2,4-triazole-κ(2)
N,N′]rhenium(I) |
title_fullStr | Crystal structure of bromido-fac-tricarbonyl[5-phenyl-3-(pyridin-2-yl)-1H-1,2,4-triazole-κ(2)
N,N′]rhenium(I) |
title_full_unstemmed | Crystal structure of bromido-fac-tricarbonyl[5-phenyl-3-(pyridin-2-yl)-1H-1,2,4-triazole-κ(2)
N,N′]rhenium(I) |
title_short | Crystal structure of bromido-fac-tricarbonyl[5-phenyl-3-(pyridin-2-yl)-1H-1,2,4-triazole-κ(2)
N,N′]rhenium(I) |
title_sort | crystal structure of bromido-fac-tricarbonyl[5-phenyl-3-(pyridin-2-yl)-1h-1,2,4-triazole-κ(2)
n,n′]rhenium(i) |
topic | Research Communications |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4257395/ https://www.ncbi.nlm.nih.gov/pubmed/25552999 http://dx.doi.org/10.1107/S1600536814025604 |
work_keys_str_mv | AT piletskakseniia crystalstructureofbromidofactricarbonyl5phenyl3pyridin2yl1h124triazolek2nnrheniumi AT domasevitchkonstantinv crystalstructureofbromidofactricarbonyl5phenyl3pyridin2yl1h124triazolek2nnrheniumi AT shtemenkoalexanderv crystalstructureofbromidofactricarbonyl5phenyl3pyridin2yl1h124triazolek2nnrheniumi |