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Three-dimensional hydrogen-bonded supra­molecular assembly in tetrakis­(1,3,5-triaza-7-phosphaadamantane)copper(I) chloride hexa­hydrate

The structure of the title compound, [Cu(PTA)(4)]Cl·6H(2)O (PTA is 1,3,5-triaza-7-phosphaadamantane, C(6)H(12)N(3)P), is composed of discrete monomeric [Cu(PTA)(4)](+) cations, chloride anions and uncoordinated water mol­ecules. The Cu(I) atom exhibits tetra­hedral coordination geometry, involving f...

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Autores principales: Kirillov, Alexander M., Smoleński, Piotr, Guedes da Silva, M. Fátima C., Kopylovich, Maximilian N., Pombeiro, Armando J. L.
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2008
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2961253/
https://www.ncbi.nlm.nih.gov/pubmed/21202164
http://dx.doi.org/10.1107/S1600536808008179
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author Kirillov, Alexander M.
Smoleński, Piotr
Guedes da Silva, M. Fátima C.
Kopylovich, Maximilian N.
Pombeiro, Armando J. L.
author_facet Kirillov, Alexander M.
Smoleński, Piotr
Guedes da Silva, M. Fátima C.
Kopylovich, Maximilian N.
Pombeiro, Armando J. L.
author_sort Kirillov, Alexander M.
collection PubMed
description The structure of the title compound, [Cu(PTA)(4)]Cl·6H(2)O (PTA is 1,3,5-triaza-7-phosphaadamantane, C(6)H(12)N(3)P), is composed of discrete monomeric [Cu(PTA)(4)](+) cations, chloride anions and uncoordinated water mol­ecules. The Cu(I) atom exhibits tetra­hedral coordination geometry, involving four symmetry-equivalent P–bound PTA ligands. The structure is extended to a regular three-dimensional supra­molecular framework via numerous equivalent O—H⋯N hydrogen bonds between all solvent water mol­ecules (six per cation) and all PTA N atoms, thus simultaneously bridging each [Cu(PTA)(4)](+) cation with 12 neighbouring units in multiple directions. The study also shows that PTA can be a convenient ligand in crystal engineering for the construction of supra­molecular architectures.
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spelling pubmed-29612532010-12-30 Three-dimensional hydrogen-bonded supra­molecular assembly in tetrakis­(1,3,5-triaza-7-phosphaadamantane)copper(I) chloride hexa­hydrate Kirillov, Alexander M. Smoleński, Piotr Guedes da Silva, M. Fátima C. Kopylovich, Maximilian N. Pombeiro, Armando J. L. Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers The structure of the title compound, [Cu(PTA)(4)]Cl·6H(2)O (PTA is 1,3,5-triaza-7-phosphaadamantane, C(6)H(12)N(3)P), is composed of discrete monomeric [Cu(PTA)(4)](+) cations, chloride anions and uncoordinated water mol­ecules. The Cu(I) atom exhibits tetra­hedral coordination geometry, involving four symmetry-equivalent P–bound PTA ligands. The structure is extended to a regular three-dimensional supra­molecular framework via numerous equivalent O—H⋯N hydrogen bonds between all solvent water mol­ecules (six per cation) and all PTA N atoms, thus simultaneously bridging each [Cu(PTA)(4)](+) cation with 12 neighbouring units in multiple directions. The study also shows that PTA can be a convenient ligand in crystal engineering for the construction of supra­molecular architectures. International Union of Crystallography 2008-04-02 /pmc/articles/PMC2961253/ /pubmed/21202164 http://dx.doi.org/10.1107/S1600536808008179 Text en © Kirillov et al. 2008 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 Metal-Organic Papers
Kirillov, Alexander M.
Smoleński, Piotr
Guedes da Silva, M. Fátima C.
Kopylovich, Maximilian N.
Pombeiro, Armando J. L.
Three-dimensional hydrogen-bonded supra­molecular assembly in tetrakis­(1,3,5-triaza-7-phosphaadamantane)copper(I) chloride hexa­hydrate
title Three-dimensional hydrogen-bonded supra­molecular assembly in tetrakis­(1,3,5-triaza-7-phosphaadamantane)copper(I) chloride hexa­hydrate
title_full Three-dimensional hydrogen-bonded supra­molecular assembly in tetrakis­(1,3,5-triaza-7-phosphaadamantane)copper(I) chloride hexa­hydrate
title_fullStr Three-dimensional hydrogen-bonded supra­molecular assembly in tetrakis­(1,3,5-triaza-7-phosphaadamantane)copper(I) chloride hexa­hydrate
title_full_unstemmed Three-dimensional hydrogen-bonded supra­molecular assembly in tetrakis­(1,3,5-triaza-7-phosphaadamantane)copper(I) chloride hexa­hydrate
title_short Three-dimensional hydrogen-bonded supra­molecular assembly in tetrakis­(1,3,5-triaza-7-phosphaadamantane)copper(I) chloride hexa­hydrate
title_sort three-dimensional hydrogen-bonded supra­molecular assembly in tetrakis­(1,3,5-triaza-7-phosphaadamantane)copper(i) chloride hexa­hydrate
topic Metal-Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2961253/
https://www.ncbi.nlm.nih.gov/pubmed/21202164
http://dx.doi.org/10.1107/S1600536808008179
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