fac-Bis(acetonitrile-κN)tricarbonyl(trifluoroacetato-κO)rhenium(I)

fac-Bis(acetonitrile-κN)tricarbonyl(trifluoroacetato-κO)rhenium(I)

In the title compound, [Re(CF3COO)(CH3CN)2(CO)3], the Re atom has a distorted octahedral configuration. The two acetonitrile molecules and two of the three carbonyl groups occupy the equatorial plane of the complex, with the third carbonyl ligand and the trifluoroacetato ligand in the axial position...

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Main Authors: Hoong-Kun Fun, Reza Kia
Format: Article
Language:English
Published: International Union of Crystallography 2008-10-01
Series:Acta Crystallographica Section E
Online Access:http://scripts.iucr.org/cgi-bin/paper?S1600536808029966
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spelling doaj-53603a4c82a9499d9e485af36c1ecc8b2020-11-25T02:40:12ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682008-10-016410m1314m131410.1107/S1600536808029966fac-Bis(acetonitrile-κN)tricarbonyl(trifluoroacetato-κO)rhenium(I)Hoong-Kun FunReza KiaIn the title compound, [Re(CF3COO)(CH3CN)2(CO)3], the Re atom has a distorted octahedral configuration. The two acetonitrile molecules and two of the three carbonyl groups occupy the equatorial plane of the complex, with the third carbonyl ligand and the trifluoroacetato ligand in the axial positions. The three carbonyl ligands are arranged in a fac configuration around the Re atom. The CF3 segment of the trifluoroacetato ligand shows rotational disorder and the refined site-occupancy factors of the disordered parts are ca 0.5/0.5. The crystal structure is stabilized by C—H...O and C—H...F hydrogen bonds.http://scripts.iucr.org/cgi-bin/paper?S1600536808029966
collection DOAJ
language English
format Article
sources DOAJ
author Hoong-Kun Fun
Reza Kia
spellingShingle Hoong-Kun Fun
Reza Kia
fac-Bis(acetonitrile-κN)tricarbonyl(trifluoroacetato-κO)rhenium(I)
Acta Crystallographica Section E
author_facet Hoong-Kun Fun
Reza Kia
author_sort Hoong-Kun Fun
title fac-Bis(acetonitrile-κN)tricarbonyl(trifluoroacetato-κO)rhenium(I)
title_short fac-Bis(acetonitrile-κN)tricarbonyl(trifluoroacetato-κO)rhenium(I)
title_full fac-Bis(acetonitrile-κN)tricarbonyl(trifluoroacetato-κO)rhenium(I)
title_fullStr fac-Bis(acetonitrile-κN)tricarbonyl(trifluoroacetato-κO)rhenium(I)
title_full_unstemmed fac-Bis(acetonitrile-κN)tricarbonyl(trifluoroacetato-κO)rhenium(I)
title_sort fac-bis(acetonitrile-κn)tricarbonyl(trifluoroacetato-κo)rhenium(i)
publisher International Union of Crystallography
series Acta Crystallographica Section E
issn 1600-5368
publishDate 2008-10-01
description In the title compound, [Re(CF3COO)(CH3CN)2(CO)3], the Re atom has a distorted octahedral configuration. The two acetonitrile molecules and two of the three carbonyl groups occupy the equatorial plane of the complex, with the third carbonyl ligand and the trifluoroacetato ligand in the axial positions. The three carbonyl ligands are arranged in a fac configuration around the Re atom. The CF3 segment of the trifluoroacetato ligand shows rotational disorder and the refined site-occupancy factors of the disordered parts are ca 0.5/0.5. The crystal structure is stabilized by C—H...O and C—H...F hydrogen bonds.
url http://scripts.iucr.org/cgi-bin/paper?S1600536808029966
work_keys_str_mv AT hoongkunfun facbisacetonitrile954ntricarbonyltrifluoroacetato954orheniumi
AT rezakia facbisacetonitrile954ntricarbonyltrifluoroacetato954orheniumi
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