Chlorido[1-diphenyl­phosphanyl-3-(phenyl­sulfan­yl)propane-κ(2) P,S](η(5)-penta­methyl­cyclo­penta­dien­yl)iridium(III) chloride monohydrate

The crystal structure of the title compound, [Ir(C(10)H(15))Cl(C(21)H(21)PS)]Cl·H(2)O, consists of discrete [Ir(η(5)-C(5)Me(5))Cl{Ph(2)P(CH(2))(3)SPh-κP,κS}](+) cations, chloride anions and water mol­ecules. The Ir(III) atom is coordinated by an η(5)-C(5)Me(5) ligand, a chloride and a Ph(2)P(CH(2))(...

Descripción completa

Detalles Bibliográficos
Autores principales: Ludwig, Gerd, Korb, Marcus, Rüffer, Tobias, Lang, Heinrich, Steinborn, Dirk
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2012
Materias:
Metal-Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3379193/
https://www.ncbi.nlm.nih.gov/pubmed/22719391
http://dx.doi.org/10.1107/S1600536812021964
_version_ 1782236143701458944
author Ludwig, Gerd
Korb, Marcus
Rüffer, Tobias
Lang, Heinrich
Steinborn, Dirk
author_facet Ludwig, Gerd
Korb, Marcus
Rüffer, Tobias
Lang, Heinrich
Steinborn, Dirk
author_sort Ludwig, Gerd
collection PubMed
description The crystal structure of the title compound, [Ir(C(10)H(15))Cl(C(21)H(21)PS)]Cl·H(2)O, consists of discrete [Ir(η(5)-C(5)Me(5))Cl{Ph(2)P(CH(2))(3)SPh-κP,κS}](+) cations, chloride anions and water mol­ecules. The Ir(III) atom is coordinated by an η(5)-C(5)Me(5) ligand, a chloride and a Ph(2)P(CH(2))(3)SPh-κP,κS ligand, leading to a three-legged piano-stool geometry. In the crystal, two water molecules and two chloride anions are linked by weak O—H⋯Cl hydrogen bonding into tetra­mers that are located on centers of inversion. The H atoms of one of the methyl groups are disordered and were refined using a split model.
format Online
Article
Text
id pubmed-3379193
institution National Center for Biotechnology Information
language English
publishDate 2012
publisher International Union of Crystallography
record_format MEDLINE/PubMed
spelling pubmed-33791932012-06-20 Chlorido[1-diphenyl­phosphanyl-3-(phenyl­sulfan­yl)propane-κ(2) P,S](η(5)-penta­methyl­cyclo­penta­dien­yl)iridium(III) chloride monohydrate Ludwig, Gerd Korb, Marcus Rüffer, Tobias Lang, Heinrich Steinborn, Dirk Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers The crystal structure of the title compound, [Ir(C(10)H(15))Cl(C(21)H(21)PS)]Cl·H(2)O, consists of discrete [Ir(η(5)-C(5)Me(5))Cl{Ph(2)P(CH(2))(3)SPh-κP,κS}](+) cations, chloride anions and water mol­ecules. The Ir(III) atom is coordinated by an η(5)-C(5)Me(5) ligand, a chloride and a Ph(2)P(CH(2))(3)SPh-κP,κS ligand, leading to a three-legged piano-stool geometry. In the crystal, two water molecules and two chloride anions are linked by weak O—H⋯Cl hydrogen bonding into tetra­mers that are located on centers of inversion. The H atoms of one of the methyl groups are disordered and were refined using a split model. International Union of Crystallography 2012-05-31 /pmc/articles/PMC3379193/ /pubmed/22719391 http://dx.doi.org/10.1107/S1600536812021964 Text en © Ludwig et al. 2012 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
Ludwig, Gerd
Korb, Marcus
Rüffer, Tobias
Lang, Heinrich
Steinborn, Dirk
Chlorido[1-diphenyl­phosphanyl-3-(phenyl­sulfan­yl)propane-κ(2) P,S](η(5)-penta­methyl­cyclo­penta­dien­yl)iridium(III) chloride monohydrate
title Chlorido[1-diphenyl­phosphanyl-3-(phenyl­sulfan­yl)propane-κ(2) P,S](η(5)-penta­methyl­cyclo­penta­dien­yl)iridium(III) chloride monohydrate
title_full Chlorido[1-diphenyl­phosphanyl-3-(phenyl­sulfan­yl)propane-κ(2) P,S](η(5)-penta­methyl­cyclo­penta­dien­yl)iridium(III) chloride monohydrate
title_fullStr Chlorido[1-diphenyl­phosphanyl-3-(phenyl­sulfan­yl)propane-κ(2) P,S](η(5)-penta­methyl­cyclo­penta­dien­yl)iridium(III) chloride monohydrate
title_full_unstemmed Chlorido[1-diphenyl­phosphanyl-3-(phenyl­sulfan­yl)propane-κ(2) P,S](η(5)-penta­methyl­cyclo­penta­dien­yl)iridium(III) chloride monohydrate
title_short Chlorido[1-diphenyl­phosphanyl-3-(phenyl­sulfan­yl)propane-κ(2) P,S](η(5)-penta­methyl­cyclo­penta­dien­yl)iridium(III) chloride monohydrate
title_sort chlorido[1-diphenyl­phosphanyl-3-(phenyl­sulfan­yl)propane-κ(2) p,s](η(5)-penta­methyl­cyclo­penta­dien­yl)iridium(iii) chloride monohydrate
topic Metal-Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3379193/
https://www.ncbi.nlm.nih.gov/pubmed/22719391
http://dx.doi.org/10.1107/S1600536812021964
work_keys_str_mv AT ludwiggerd chlorido1diphenylphosphanyl3phenylsulfanylpropanek2psē5pentamethylcyclopentadienyliridiumiiichloridemonohydrate
AT korbmarcus chlorido1diphenylphosphanyl3phenylsulfanylpropanek2psē5pentamethylcyclopentadienyliridiumiiichloridemonohydrate
AT ruffertobias chlorido1diphenylphosphanyl3phenylsulfanylpropanek2psē5pentamethylcyclopentadienyliridiumiiichloridemonohydrate
AT langheinrich chlorido1diphenylphosphanyl3phenylsulfanylpropanek2psē5pentamethylcyclopentadienyliridiumiiichloridemonohydrate
AT steinborndirk chlorido1diphenylphosphanyl3phenylsulfanylpropanek2psē5pentamethylcyclopentadienyliridiumiiichloridemonohydrate

Ejemplares similares