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Crystal structure of {(S)-1-phenyl-N,N-bis[(pyridin-2-yl)methyl]ethanamine-κ(3) N,N′,N′′}bis(thiocyanato-κN)zinc from synchrotron data
The title Zn(II) complex, [Zn(NCS)(2)(C(20)H(21)N(3))], has been characterized by synchrotron single-crystal diffraction and FT–IR spectroscopy. The central Zn(II) ion has a distorted square-pyramidal coordination geometry, with three N atoms of the chiral (S) 1-phenyl-N,N-bis[(pyridin-2-yl)methyl...
Autores principales: | , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2017
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5209761/ https://www.ncbi.nlm.nih.gov/pubmed/28083125 http://dx.doi.org/10.1107/S2056989016019253 |
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author | Lee, Dong Won Shin, Jong Won |
author_facet | Lee, Dong Won Shin, Jong Won |
author_sort | Lee, Dong Won |
collection | PubMed |
description | The title Zn(II) complex, [Zn(NCS)(2)(C(20)H(21)N(3))], has been characterized by synchrotron single-crystal diffraction and FT–IR spectroscopy. The central Zn(II) ion has a distorted square-pyramidal coordination geometry, with three N atoms of the chiral (S) 1-phenyl-N,N-bis[(pyridin-2-yl)methyl]ethanamine (S-ppme) ligand and one N atom of a thiocyanate anion in the equatorial plane, and one N atom of another thiocyanate anion at the apical position. The average Zn—N(S-ppme) and Zn—N(NCS) bond lengths are 2.183 (2) and 1.986 (2) Å, respectively. In the crystal, intermolecular C—H⋯S hydrogen bonds and a face-to-face π–π interaction [centroid–centroid distance = 3.482 (1) Å] link the molecules and give rise to a supramolecular sheet structure parallel to the ac plane. |
format | Online Article Text |
id | pubmed-5209761 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2017 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-52097612017-01-12 Crystal structure of {(S)-1-phenyl-N,N-bis[(pyridin-2-yl)methyl]ethanamine-κ(3) N,N′,N′′}bis(thiocyanato-κN)zinc from synchrotron data Lee, Dong Won Shin, Jong Won Acta Crystallogr E Crystallogr Commun Research Communications The title Zn(II) complex, [Zn(NCS)(2)(C(20)H(21)N(3))], has been characterized by synchrotron single-crystal diffraction and FT–IR spectroscopy. The central Zn(II) ion has a distorted square-pyramidal coordination geometry, with three N atoms of the chiral (S) 1-phenyl-N,N-bis[(pyridin-2-yl)methyl]ethanamine (S-ppme) ligand and one N atom of a thiocyanate anion in the equatorial plane, and one N atom of another thiocyanate anion at the apical position. The average Zn—N(S-ppme) and Zn—N(NCS) bond lengths are 2.183 (2) and 1.986 (2) Å, respectively. In the crystal, intermolecular C—H⋯S hydrogen bonds and a face-to-face π–π interaction [centroid–centroid distance = 3.482 (1) Å] link the molecules and give rise to a supramolecular sheet structure parallel to the ac plane. International Union of Crystallography 2017-01-01 /pmc/articles/PMC5209761/ /pubmed/28083125 http://dx.doi.org/10.1107/S2056989016019253 Text en © Lee and Shin 2017 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 Lee, Dong Won Shin, Jong Won Crystal structure of {(S)-1-phenyl-N,N-bis[(pyridin-2-yl)methyl]ethanamine-κ(3) N,N′,N′′}bis(thiocyanato-κN)zinc from synchrotron data |
title | Crystal structure of {(S)-1-phenyl-N,N-bis[(pyridin-2-yl)methyl]ethanamine-κ(3)
N,N′,N′′}bis(thiocyanato-κN)zinc from synchrotron data |
title_full | Crystal structure of {(S)-1-phenyl-N,N-bis[(pyridin-2-yl)methyl]ethanamine-κ(3)
N,N′,N′′}bis(thiocyanato-κN)zinc from synchrotron data |
title_fullStr | Crystal structure of {(S)-1-phenyl-N,N-bis[(pyridin-2-yl)methyl]ethanamine-κ(3)
N,N′,N′′}bis(thiocyanato-κN)zinc from synchrotron data |
title_full_unstemmed | Crystal structure of {(S)-1-phenyl-N,N-bis[(pyridin-2-yl)methyl]ethanamine-κ(3)
N,N′,N′′}bis(thiocyanato-κN)zinc from synchrotron data |
title_short | Crystal structure of {(S)-1-phenyl-N,N-bis[(pyridin-2-yl)methyl]ethanamine-κ(3)
N,N′,N′′}bis(thiocyanato-κN)zinc from synchrotron data |
title_sort | crystal structure of {(s)-1-phenyl-n,n-bis[(pyridin-2-yl)methyl]ethanamine-κ(3)
n,n′,n′′}bis(thiocyanato-κn)zinc from synchrotron data |
topic | Research Communications |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5209761/ https://www.ncbi.nlm.nih.gov/pubmed/28083125 http://dx.doi.org/10.1107/S2056989016019253 |
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