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Co(NCS)(2)(abpt)(2) and Ni(NCS)(2)(abpt)(2) [abpt is 4-amino-3,5-bis­(pyridin-2-yl)-1,2,4-triazole]: structural characterization of polymorphs A and B

The synthesis and structures of bis­[4-amino-3,5-bis­(pyridin-2-yl)-1,2,4-triazole-κ(2) N (2),N (3)]bis­(thio­cyanato-κN)cobalt(II), [Co(NCS)(2)(C(12)H(10)N(6))(2)] or Co(NCS)(2)(abpt)(2), and bis­[4-amino-3,5-bis­(pyridin-2-yl)-1,2,4-triazole-κ(2) N (2),N (3)]bis­(thio­cyan­ato-κN)nickel(II), [Ni(N...

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Detalles Bibliográficos
Autores principales: Mason, Helen E., Howard, Judith A. K., Sparkes, Hazel A.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2021
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8645156/
https://www.ncbi.nlm.nih.gov/pubmed/34864720
http://dx.doi.org/10.1107/S2053229621010251
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author Mason, Helen E.
Howard, Judith A. K.
Sparkes, Hazel A.
author_facet Mason, Helen E.
Howard, Judith A. K.
Sparkes, Hazel A.
author_sort Mason, Helen E.
collection PubMed
description The synthesis and structures of bis­[4-amino-3,5-bis­(pyridin-2-yl)-1,2,4-triazole-κ(2) N (2),N (3)]bis­(thio­cyanato-κN)cobalt(II), [Co(NCS)(2)(C(12)H(10)N(6))(2)] or Co(NCS)(2)(abpt)(2), and bis­[4-amino-3,5-bis­(pyridin-2-yl)-1,2,4-triazole-κ(2) N (2),N (3)]bis­(thio­cyan­ato-κN)nickel(II), [Ni(NCS)(2)(C(12)H(10)N(6))(2)] or Ni(NCS)(2)(abpt)(2), are reported. In both cases, two polymorphs, A and B, were identified and structurally characterized. For both polymorphs, the structures obtained with the different metals, i.e. Co(II) or Ni(II), were found to be isostructural. All of the structures contained an intra­molecular N—H⋯N hydrogen bond, C—H⋯N inter­actions and π–π stacking inter­actions. No structural evidence was observed for a thermal spin crossover for either of the Co(NCS)(2)(abpt)(2) polymorphs between 300 (2) and 120 (2) K.
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spelling pubmed-86451562021-12-07 Co(NCS)(2)(abpt)(2) and Ni(NCS)(2)(abpt)(2) [abpt is 4-amino-3,5-bis­(pyridin-2-yl)-1,2,4-triazole]: structural characterization of polymorphs A and B Mason, Helen E. Howard, Judith A. K. Sparkes, Hazel A. Acta Crystallogr C Struct Chem Research Papers The synthesis and structures of bis­[4-amino-3,5-bis­(pyridin-2-yl)-1,2,4-triazole-κ(2) N (2),N (3)]bis­(thio­cyanato-κN)cobalt(II), [Co(NCS)(2)(C(12)H(10)N(6))(2)] or Co(NCS)(2)(abpt)(2), and bis­[4-amino-3,5-bis­(pyridin-2-yl)-1,2,4-triazole-κ(2) N (2),N (3)]bis­(thio­cyan­ato-κN)nickel(II), [Ni(NCS)(2)(C(12)H(10)N(6))(2)] or Ni(NCS)(2)(abpt)(2), are reported. In both cases, two polymorphs, A and B, were identified and structurally characterized. For both polymorphs, the structures obtained with the different metals, i.e. Co(II) or Ni(II), were found to be isostructural. All of the structures contained an intra­molecular N—H⋯N hydrogen bond, C—H⋯N inter­actions and π–π stacking inter­actions. No structural evidence was observed for a thermal spin crossover for either of the Co(NCS)(2)(abpt)(2) polymorphs between 300 (2) and 120 (2) K. International Union of Crystallography 2021-11-16 /pmc/articles/PMC8645156/ /pubmed/34864720 http://dx.doi.org/10.1107/S2053229621010251 Text en © Mason et al. 2021 https://creativecommons.org/licenses/by/4.0/This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.
spellingShingle Research Papers
Mason, Helen E.
Howard, Judith A. K.
Sparkes, Hazel A.
Co(NCS)(2)(abpt)(2) and Ni(NCS)(2)(abpt)(2) [abpt is 4-amino-3,5-bis­(pyridin-2-yl)-1,2,4-triazole]: structural characterization of polymorphs A and B
title Co(NCS)(2)(abpt)(2) and Ni(NCS)(2)(abpt)(2) [abpt is 4-amino-3,5-bis­(pyridin-2-yl)-1,2,4-triazole]: structural characterization of polymorphs A and B
title_full Co(NCS)(2)(abpt)(2) and Ni(NCS)(2)(abpt)(2) [abpt is 4-amino-3,5-bis­(pyridin-2-yl)-1,2,4-triazole]: structural characterization of polymorphs A and B
title_fullStr Co(NCS)(2)(abpt)(2) and Ni(NCS)(2)(abpt)(2) [abpt is 4-amino-3,5-bis­(pyridin-2-yl)-1,2,4-triazole]: structural characterization of polymorphs A and B
title_full_unstemmed Co(NCS)(2)(abpt)(2) and Ni(NCS)(2)(abpt)(2) [abpt is 4-amino-3,5-bis­(pyridin-2-yl)-1,2,4-triazole]: structural characterization of polymorphs A and B
title_short Co(NCS)(2)(abpt)(2) and Ni(NCS)(2)(abpt)(2) [abpt is 4-amino-3,5-bis­(pyridin-2-yl)-1,2,4-triazole]: structural characterization of polymorphs A and B
title_sort co(ncs)(2)(abpt)(2) and ni(ncs)(2)(abpt)(2) [abpt is 4-amino-3,5-bis­(pyridin-2-yl)-1,2,4-triazole]: structural characterization of polymorphs a and b
topic Research Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8645156/
https://www.ncbi.nlm.nih.gov/pubmed/34864720
http://dx.doi.org/10.1107/S2053229621010251
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