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A new monoclinic polymorph of 1,1′-bis­(di­phenyl­thio­phosphor­yl)ferrocene

The title compound, [Fe(C(17)H(14)PS)(2)], is a second monoclinic polymorph (P2(1)/c, with Z′ = 1) of the previously reported monoclinic (C2/c, with Z′ = 1/2) form [Fang et al. (1995 ▸). Polyhedron, 14, 2403–2409]. In the new form, the S atoms lie to the same side of the mol­ecule with the pseudo S—...

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Autores principales: Tan, Yee Seng, Yeo, Chien Ing, Tiekink, Edward R. T.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2015
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4571348/
https://www.ncbi.nlm.nih.gov/pubmed/26396747
http://dx.doi.org/10.1107/S2056989015012682
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author Tan, Yee Seng
Yeo, Chien Ing
Tiekink, Edward R. T.
author_facet Tan, Yee Seng
Yeo, Chien Ing
Tiekink, Edward R. T.
author_sort Tan, Yee Seng
collection PubMed
description The title compound, [Fe(C(17)H(14)PS)(2)], is a second monoclinic polymorph (P2(1)/c, with Z′ = 1) of the previously reported monoclinic (C2/c, with Z′ = 1/2) form [Fang et al. (1995 ▸). Polyhedron, 14, 2403–2409]. In the new form, the S atoms lie to the same side of the mol­ecule with the pseudo S—P⋯P—S torsion angle being −53.09 (3)°. By contrast to this almost syn disposition, in the C2/c polymorph, the Fe atom lies on a centre of inversion so that the S atoms are strictly anti, with a pseudo-S—P⋯P—S torsion angle of 180°. The significant difference in mol­ecular conformation between the two forms does not result in major perturbations in the P=S bond lengths nor in the distorted tetra­hedral geometries about the P atoms. The crystal packing of the new monoclinic polymorph features weak Cp—C—H⋯π(phen­yl) inter­actions consolidating linear supra­molecular chains along the a axis. These pack with no directional inter­actions between them.
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spelling pubmed-45713482015-09-22 A new monoclinic polymorph of 1,1′-bis­(di­phenyl­thio­phosphor­yl)ferrocene Tan, Yee Seng Yeo, Chien Ing Tiekink, Edward R. T. Acta Crystallogr E Crystallogr Commun Research Communications The title compound, [Fe(C(17)H(14)PS)(2)], is a second monoclinic polymorph (P2(1)/c, with Z′ = 1) of the previously reported monoclinic (C2/c, with Z′ = 1/2) form [Fang et al. (1995 ▸). Polyhedron, 14, 2403–2409]. In the new form, the S atoms lie to the same side of the mol­ecule with the pseudo S—P⋯P—S torsion angle being −53.09 (3)°. By contrast to this almost syn disposition, in the C2/c polymorph, the Fe atom lies on a centre of inversion so that the S atoms are strictly anti, with a pseudo-S—P⋯P—S torsion angle of 180°. The significant difference in mol­ecular conformation between the two forms does not result in major perturbations in the P=S bond lengths nor in the distorted tetra­hedral geometries about the P atoms. The crystal packing of the new monoclinic polymorph features weak Cp—C—H⋯π(phen­yl) inter­actions consolidating linear supra­molecular chains along the a axis. These pack with no directional inter­actions between them. International Union of Crystallography 2015-07-04 /pmc/articles/PMC4571348/ /pubmed/26396747 http://dx.doi.org/10.1107/S2056989015012682 Text en © Tan et al. 2015 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
Tan, Yee Seng
Yeo, Chien Ing
Tiekink, Edward R. T.
A new monoclinic polymorph of 1,1′-bis­(di­phenyl­thio­phosphor­yl)ferrocene
title A new monoclinic polymorph of 1,1′-bis­(di­phenyl­thio­phosphor­yl)ferrocene
title_full A new monoclinic polymorph of 1,1′-bis­(di­phenyl­thio­phosphor­yl)ferrocene
title_fullStr A new monoclinic polymorph of 1,1′-bis­(di­phenyl­thio­phosphor­yl)ferrocene
title_full_unstemmed A new monoclinic polymorph of 1,1′-bis­(di­phenyl­thio­phosphor­yl)ferrocene
title_short A new monoclinic polymorph of 1,1′-bis­(di­phenyl­thio­phosphor­yl)ferrocene
title_sort new monoclinic polymorph of 1,1′-bis­(di­phenyl­thio­phosphor­yl)ferrocene
topic Research Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4571348/
https://www.ncbi.nlm.nih.gov/pubmed/26396747
http://dx.doi.org/10.1107/S2056989015012682
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