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Crystal structures of 9-[bis(benzylsulfanyl)methyl]anthracene and of cyclo-dodecakis(μ(2)-phenylmethanethiolato-κ(2) S:S)hexapalladium(6 Pd—Pd)–anthracene-9,10-dione (1/1)
The first title compound, C(29)H(24)S(2), L1, represents an example of an anthracene-based functionalized dithioether, which may be useful as a potential chelating or terminal ligand for coordination chemistry. This dithioacetal L1 crystallizes in the monoclinic space group P2(1)/c. The phenyl r...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
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International Union of Crystallography
2021
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8382052/ https://www.ncbi.nlm.nih.gov/pubmed/34513018 http://dx.doi.org/10.1107/S2056989021006113 |
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author | Raghuvanshi, Abhinav Krupp, Anna Viau, Lydie Knorr, Michael Strohmann, Carsten |
author_facet | Raghuvanshi, Abhinav Krupp, Anna Viau, Lydie Knorr, Michael Strohmann, Carsten |
author_sort | Raghuvanshi, Abhinav |
collection | PubMed |
description | The first title compound, C(29)H(24)S(2), L1, represents an example of an anthracene-based functionalized dithioether, which may be useful as a potential chelating or terminal ligand for coordination chemistry. This dithioacetal L1 crystallizes in the monoclinic space group P2(1)/c. The phenyl rings of the benzyl groups and that of the anthracene unit form dihedral angles of 49.21 (4) and 58.79 (5)° and the crystal structure displays short C–H⋯π contacts. Surprisingly, when attempting to coordinate L1 to [PdCl(2)(PhCN)(2)], instead of the targeted chelate complex [PdCl(2)(κ(2)-L1)], a cleavage reaction leads to the formation of the centrosymmetric hexanuclear cyclic cluster of composition [Pd(6)(μ(2)-SCH(2)Ph)(12)] Pd6, or [Pd(6)(C(7)H(7)S)(12)]·C(14)H(8)O(2). This tiara-shaped hexamer crystallizing in the triclinic space group P [Image: see text] consists of six approximately square planar Pd(II)S(4) centers, which are interconnected through twelve μ(2)-bridging benzyl thiolate groups. The Pd⋯Pd contacts range from 3.0892 (2) to 3.1609 (2) Å and can be considered as weakly bonding. The unit cell of Pd6 contains also a co-crystallized anthracene-9,10-dione molecule. |
format | Online Article Text |
id | pubmed-8382052 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2021 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-83820522021-09-09 Crystal structures of 9-[bis(benzylsulfanyl)methyl]anthracene and of cyclo-dodecakis(μ(2)-phenylmethanethiolato-κ(2) S:S)hexapalladium(6 Pd—Pd)–anthracene-9,10-dione (1/1) Raghuvanshi, Abhinav Krupp, Anna Viau, Lydie Knorr, Michael Strohmann, Carsten Acta Crystallogr E Crystallogr Commun Research Communications The first title compound, C(29)H(24)S(2), L1, represents an example of an anthracene-based functionalized dithioether, which may be useful as a potential chelating or terminal ligand for coordination chemistry. This dithioacetal L1 crystallizes in the monoclinic space group P2(1)/c. The phenyl rings of the benzyl groups and that of the anthracene unit form dihedral angles of 49.21 (4) and 58.79 (5)° and the crystal structure displays short C–H⋯π contacts. Surprisingly, when attempting to coordinate L1 to [PdCl(2)(PhCN)(2)], instead of the targeted chelate complex [PdCl(2)(κ(2)-L1)], a cleavage reaction leads to the formation of the centrosymmetric hexanuclear cyclic cluster of composition [Pd(6)(μ(2)-SCH(2)Ph)(12)] Pd6, or [Pd(6)(C(7)H(7)S)(12)]·C(14)H(8)O(2). This tiara-shaped hexamer crystallizing in the triclinic space group P [Image: see text] consists of six approximately square planar Pd(II)S(4) centers, which are interconnected through twelve μ(2)-bridging benzyl thiolate groups. The Pd⋯Pd contacts range from 3.0892 (2) to 3.1609 (2) Å and can be considered as weakly bonding. The unit cell of Pd6 contains also a co-crystallized anthracene-9,10-dione molecule. International Union of Crystallography 2021-06-18 /pmc/articles/PMC8382052/ /pubmed/34513018 http://dx.doi.org/10.1107/S2056989021006113 Text en © Raghuvanshi 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 Communications Raghuvanshi, Abhinav Krupp, Anna Viau, Lydie Knorr, Michael Strohmann, Carsten Crystal structures of 9-[bis(benzylsulfanyl)methyl]anthracene and of cyclo-dodecakis(μ(2)-phenylmethanethiolato-κ(2) S:S)hexapalladium(6 Pd—Pd)–anthracene-9,10-dione (1/1) |
title | Crystal structures of 9-[bis(benzylsulfanyl)methyl]anthracene and of cyclo-dodecakis(μ(2)-phenylmethanethiolato-κ(2)
S:S)hexapalladium(6 Pd—Pd)–anthracene-9,10-dione (1/1) |
title_full | Crystal structures of 9-[bis(benzylsulfanyl)methyl]anthracene and of cyclo-dodecakis(μ(2)-phenylmethanethiolato-κ(2)
S:S)hexapalladium(6 Pd—Pd)–anthracene-9,10-dione (1/1) |
title_fullStr | Crystal structures of 9-[bis(benzylsulfanyl)methyl]anthracene and of cyclo-dodecakis(μ(2)-phenylmethanethiolato-κ(2)
S:S)hexapalladium(6 Pd—Pd)–anthracene-9,10-dione (1/1) |
title_full_unstemmed | Crystal structures of 9-[bis(benzylsulfanyl)methyl]anthracene and of cyclo-dodecakis(μ(2)-phenylmethanethiolato-κ(2)
S:S)hexapalladium(6 Pd—Pd)–anthracene-9,10-dione (1/1) |
title_short | Crystal structures of 9-[bis(benzylsulfanyl)methyl]anthracene and of cyclo-dodecakis(μ(2)-phenylmethanethiolato-κ(2)
S:S)hexapalladium(6 Pd—Pd)–anthracene-9,10-dione (1/1) |
title_sort | crystal structures of 9-[bis(benzylsulfanyl)methyl]anthracene and of cyclo-dodecakis(μ(2)-phenylmethanethiolato-κ(2)
s:s)hexapalladium(6 pd—pd)–anthracene-9,10-dione (1/1) |
topic | Research Communications |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8382052/ https://www.ncbi.nlm.nih.gov/pubmed/34513018 http://dx.doi.org/10.1107/S2056989021006113 |
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