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Carbon­yl[tris­(3,5-diphenyl­pyrazol-1-yl-κN (2))methane]copper(I) hexa­fluorido­phosphate–dichloro­methane–diethyl ether (4/3/1)

In the title compound, [Cu(C(46)H(34)N(6))(CO)]PF(6)·0.75CH(2)Cl(2)·0.25C(4)H(10)O, the Cu(I) atom is coordinated by three N atoms from the tridentate chelating tris­(3,5-diphenyl­pyrazol-1-yl)methane ligand (average Cu—N distance = 2.055 Å) and the C atom from a carbon monoxide ligand in a distorte...

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Autores principales: Miller, Katie E., Schopp, Lauren M., Nesseth, Kelly N., Moore, Curtis, Rheingold, Arnold L., Daley, Christopher J. A.
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2009
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2971318/
https://www.ncbi.nlm.nih.gov/pubmed/21578109
http://dx.doi.org/10.1107/S1600536809040781
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author Miller, Katie E.
Schopp, Lauren M.
Nesseth, Kelly N.
Moore, Curtis
Rheingold, Arnold L.
Daley, Christopher J. A.
author_facet Miller, Katie E.
Schopp, Lauren M.
Nesseth, Kelly N.
Moore, Curtis
Rheingold, Arnold L.
Daley, Christopher J. A.
author_sort Miller, Katie E.
collection PubMed
description In the title compound, [Cu(C(46)H(34)N(6))(CO)]PF(6)·0.75CH(2)Cl(2)·0.25C(4)H(10)O, the Cu(I) atom is coordinated by three N atoms from the tridentate chelating tris­(3,5-diphenyl­pyrazol-1-yl)methane ligand (average Cu—N distance = 2.055 Å) and the C atom from a carbon monoxide ligand in a distorted tetra­hedral coordination geometry. The average N—Cu—N angle between adjacent pyrazole-ring-coordinated N atoms is 88.6°, while the average N—Cu—C angle between the pyrazole-bound N atom and the C atom of carbon monoxide is 126.3°. One of the 3-phenyl rings of the tris­(pyrazol­yl)methane ligand is disordered over two sites each with an occupancy factor of 0.50. The structure also exhibits disorder of the monosolvate that has been modeled with 0.75 CH(2)Cl(2) and 0.25 Et(2)O occupancy.
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spelling pubmed-29713182010-12-30 Carbon­yl[tris­(3,5-diphenyl­pyrazol-1-yl-κN (2))methane]copper(I) hexa­fluorido­phosphate–dichloro­methane–diethyl ether (4/3/1) Miller, Katie E. Schopp, Lauren M. Nesseth, Kelly N. Moore, Curtis Rheingold, Arnold L. Daley, Christopher J. A. Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers In the title compound, [Cu(C(46)H(34)N(6))(CO)]PF(6)·0.75CH(2)Cl(2)·0.25C(4)H(10)O, the Cu(I) atom is coordinated by three N atoms from the tridentate chelating tris­(3,5-diphenyl­pyrazol-1-yl)methane ligand (average Cu—N distance = 2.055 Å) and the C atom from a carbon monoxide ligand in a distorted tetra­hedral coordination geometry. The average N—Cu—N angle between adjacent pyrazole-ring-coordinated N atoms is 88.6°, while the average N—Cu—C angle between the pyrazole-bound N atom and the C atom of carbon monoxide is 126.3°. One of the 3-phenyl rings of the tris­(pyrazol­yl)methane ligand is disordered over two sites each with an occupancy factor of 0.50. The structure also exhibits disorder of the monosolvate that has been modeled with 0.75 CH(2)Cl(2) and 0.25 Et(2)O occupancy. International Union of Crystallography 2009-10-13 /pmc/articles/PMC2971318/ /pubmed/21578109 http://dx.doi.org/10.1107/S1600536809040781 Text en © Miller et al. 2009 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
Miller, Katie E.
Schopp, Lauren M.
Nesseth, Kelly N.
Moore, Curtis
Rheingold, Arnold L.
Daley, Christopher J. A.
Carbon­yl[tris­(3,5-diphenyl­pyrazol-1-yl-κN (2))methane]copper(I) hexa­fluorido­phosphate–dichloro­methane–diethyl ether (4/3/1)
title Carbon­yl[tris­(3,5-diphenyl­pyrazol-1-yl-κN (2))methane]copper(I) hexa­fluorido­phosphate–dichloro­methane–diethyl ether (4/3/1)
title_full Carbon­yl[tris­(3,5-diphenyl­pyrazol-1-yl-κN (2))methane]copper(I) hexa­fluorido­phosphate–dichloro­methane–diethyl ether (4/3/1)
title_fullStr Carbon­yl[tris­(3,5-diphenyl­pyrazol-1-yl-κN (2))methane]copper(I) hexa­fluorido­phosphate–dichloro­methane–diethyl ether (4/3/1)
title_full_unstemmed Carbon­yl[tris­(3,5-diphenyl­pyrazol-1-yl-κN (2))methane]copper(I) hexa­fluorido­phosphate–dichloro­methane–diethyl ether (4/3/1)
title_short Carbon­yl[tris­(3,5-diphenyl­pyrazol-1-yl-κN (2))methane]copper(I) hexa­fluorido­phosphate–dichloro­methane–diethyl ether (4/3/1)
title_sort carbon­yl[tris­(3,5-diphenyl­pyrazol-1-yl-κn (2))methane]copper(i) hexa­fluorido­phosphate–dichloro­methane–diethyl ether (4/3/1)
topic Metal-Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2971318/
https://www.ncbi.nlm.nih.gov/pubmed/21578109
http://dx.doi.org/10.1107/S1600536809040781
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