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Chlorido[1-diphenyl-phosphanyl-3-(phenyl-sulfan-yl)propane-κ(2)P,S](η(5)-penta-methyl-cyclo-penta-dien-yl)iridium(III) chloride monohydrate.

Ludwig G, Korb M, Rüffer T, Lang H, Steinborn D - Acta Crystallogr Sect E Struct Rep Online (2012)

Bottom Line: 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 tetra-mers 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.

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ABSTRACT
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 mol-ecules. 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 tetra-mers 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.

No MeSH data available.


Structure of title compound [Ir(η5-C5Me5)Cl{Ph2P(CH2)3SPh-κP,κS}]Cl.H2O. Displacement ellipsoids are drawn at the 50% probability level and the H atoms are shown as small spheres of arbitrary radii. Disordering is shown as full and dashed bonds.
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Fap1: Structure of title compound [Ir(η5-C5Me5)Cl{Ph2P(CH2)3SPh-κP,κS}]Cl.H2O. Displacement ellipsoids are drawn at the 50% probability level and the H atoms are shown as small spheres of arbitrary radii. Disordering is shown as full and dashed bonds.


Chlorido[1-diphenyl-phosphanyl-3-(phenyl-sulfan-yl)propane-κ(2)P,S](η(5)-penta-methyl-cyclo-penta-dien-yl)iridium(III) chloride monohydrate.

Ludwig G, Korb M, Rüffer T, Lang H, Steinborn D - Acta Crystallogr Sect E Struct Rep Online (2012)

Structure of title compound [Ir(η5-C5Me5)Cl{Ph2P(CH2)3SPh-κP,κS}]Cl.H2O. Displacement ellipsoids are drawn at the 50% probability level and the H atoms are shown as small spheres of arbitrary radii. Disordering is shown as full and dashed bonds.
© Copyright Policy - open-access
Related In: Results  -  Collection

License
Show All Figures
getmorefigures.php?uid=PMC3379193&req=5

Fap1: Structure of title compound [Ir(η5-C5Me5)Cl{Ph2P(CH2)3SPh-κP,κS}]Cl.H2O. Displacement ellipsoids are drawn at the 50% probability level and the H atoms are shown as small spheres of arbitrary radii. Disordering is shown as full and dashed bonds.
Bottom Line: 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 tetra-mers 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.

View Article: PubMed Central - HTML - PubMed

ABSTRACT
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 mol-ecules. 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 tetra-mers 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.

No MeSH data available.