(2-Bromoacetyl)ferrocene
In the title molecule, [Fe(C5H5)(C7H6BrO)], the C atoms of the substituted ring have disparate Fe-C bond lengths compared with the unsubstituted ring. In the bromoacetyl residue, the Br and O atoms are co-planar [the O-C-C-Br torsion angle is 5.7 (4)degrees] and are syn to each other. Helical supram...
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2011
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my.um.eprints.146282019-01-30T08:28:44Z http://eprints.um.edu.my/14628/ (2-Bromoacetyl)ferrocene Wu, Xiang-Xiang Zhu, Xin Ma, Qiu-Juan Ng, S.W. Tiekink, E.R.T. QC Physics In the title molecule, [Fe(C5H5)(C7H6BrO)], the C atoms of the substituted ring have disparate Fe-C bond lengths compared with the unsubstituted ring. In the bromoacetyl residue, the Br and O atoms are co-planar [the O-C-C-Br torsion angle is 5.7 (4)degrees] and are syn to each other. Helical supramolecular chains along the b axis are formed in the crystal structure mediated by C-H center dot center dot center dot O contacts; the carbonyl-O atom is bifurcated. The chains are linked into layers by C-H center dot center dot center dot pi (unsubstituted ring) interactions that stack along the a-axis direction. International Union of Crystallography 2011 Article PeerReviewed Wu, Xiang-Xiang and Zhu, Xin and Ma, Qiu-Juan and Ng, S.W. and Tiekink, E.R.T. (2011) (2-Bromoacetyl)ferrocene. Acta Crystallographica Section E: Structure Reports Online, 67 (12). M1875-U649. ISSN 1600-5368 |
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QC Physics Wu, Xiang-Xiang Zhu, Xin Ma, Qiu-Juan Ng, S.W. Tiekink, E.R.T. (2-Bromoacetyl)ferrocene |
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In the title molecule, [Fe(C5H5)(C7H6BrO)], the C atoms of the substituted ring have disparate Fe-C bond lengths compared with the unsubstituted ring. In the bromoacetyl residue, the Br and O atoms are co-planar [the O-C-C-Br torsion angle is 5.7 (4)degrees] and are syn to each other. Helical supramolecular chains along the b axis are formed in the crystal structure mediated by C-H center dot center dot center dot O contacts; the carbonyl-O atom is bifurcated. The chains are linked into layers by C-H center dot center dot center dot pi (unsubstituted ring) interactions that stack along the a-axis direction. |
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Article |
author |
Wu, Xiang-Xiang Zhu, Xin Ma, Qiu-Juan Ng, S.W. Tiekink, E.R.T. |
author_facet |
Wu, Xiang-Xiang Zhu, Xin Ma, Qiu-Juan Ng, S.W. Tiekink, E.R.T. |
author_sort |
Wu, Xiang-Xiang |
title |
(2-Bromoacetyl)ferrocene |
title_short |
(2-Bromoacetyl)ferrocene |
title_full |
(2-Bromoacetyl)ferrocene |
title_fullStr |
(2-Bromoacetyl)ferrocene |
title_full_unstemmed |
(2-Bromoacetyl)ferrocene |
title_sort |
(2-bromoacetyl)ferrocene |
publisher |
International Union of Crystallography |
publishDate |
2011 |
url |
http://eprints.um.edu.my/14628/ |
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1643689861715066880 |