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Ferrocenylbutadiyne
The title compound, [Fe(C(5)H(5))(C(9)H(5))], crystallizes in a form of a π–π-stacked assembly formed as a result of strong intermolecular π–π interactions between (a) the triple bonds of two neighboring butadiyne substituents overlapping in a ‘head-to-tail’ fashion [characterized by C⋯C short con...
Autores principales: | , , |
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Formato: | Texto |
Lenguaje: | English |
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International Union of Crystallography
2009
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2968460/ https://www.ncbi.nlm.nih.gov/pubmed/21582079 http://dx.doi.org/10.1107/S1600536809005522 |
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author | Nemykin, Victor N. Dorweiler, Jason D. Subbotin, Roman I. |
author_facet | Nemykin, Victor N. Dorweiler, Jason D. Subbotin, Roman I. |
author_sort | Nemykin, Victor N. |
collection | PubMed |
description | The title compound, [Fe(C(5)H(5))(C(9)H(5))], crystallizes in a form of a π–π-stacked assembly formed as a result of strong intermolecular π–π interactions between (a) the triple bonds of two neighboring butadiyne substituents overlapping in a ‘head-to-tail’ fashion [characterized by C⋯C short contacts of 3.622 (5), 3.567 (6) and 3.556 (6) Å] and (b) the triple bonds of the butadiyne substituent and substituted cyclopendadiene ring of neighboring molecules [C⋯C = 3.474 (5) and 3.492 (6) Å]. The linear butadiyne substituent has alternating C—C triple and single bonds, while the unsubstituted cyclopentadiene ring is slightly positionally disordered (although the structure reported here was solved as non-disordered) and retains a close to eclipsed conformation. |
format | Text |
id | pubmed-2968460 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2009 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-29684602010-12-30 Ferrocenylbutadiyne Nemykin, Victor N. Dorweiler, Jason D. Subbotin, Roman I. Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers The title compound, [Fe(C(5)H(5))(C(9)H(5))], crystallizes in a form of a π–π-stacked assembly formed as a result of strong intermolecular π–π interactions between (a) the triple bonds of two neighboring butadiyne substituents overlapping in a ‘head-to-tail’ fashion [characterized by C⋯C short contacts of 3.622 (5), 3.567 (6) and 3.556 (6) Å] and (b) the triple bonds of the butadiyne substituent and substituted cyclopendadiene ring of neighboring molecules [C⋯C = 3.474 (5) and 3.492 (6) Å]. The linear butadiyne substituent has alternating C—C triple and single bonds, while the unsubstituted cyclopentadiene ring is slightly positionally disordered (although the structure reported here was solved as non-disordered) and retains a close to eclipsed conformation. International Union of Crystallography 2009-02-21 /pmc/articles/PMC2968460/ /pubmed/21582079 http://dx.doi.org/10.1107/S1600536809005522 Text en © Nemykin 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 Nemykin, Victor N. Dorweiler, Jason D. Subbotin, Roman I. Ferrocenylbutadiyne |
title | Ferrocenylbutadiyne |
title_full | Ferrocenylbutadiyne |
title_fullStr | Ferrocenylbutadiyne |
title_full_unstemmed | Ferrocenylbutadiyne |
title_short | Ferrocenylbutadiyne |
title_sort | ferrocenylbutadiyne |
topic | Metal-Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2968460/ https://www.ncbi.nlm.nih.gov/pubmed/21582079 http://dx.doi.org/10.1107/S1600536809005522 |
work_keys_str_mv | AT nemykinvictorn ferrocenylbutadiyne AT dorweilerjasond ferrocenylbutadiyne AT subbotinromani ferrocenylbutadiyne |