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Crystal structure of rac-3,9-bis(2,6-difluorophenyl)-2,4,8,10-tetraoxaspiro[5.5]undecane
The title compound, C(19)H(16)F(4)O(4), was prepared by the condensation reaction of 2,6-difluorobenzaldehyde and pentaerythritol. The whole molecule is generated by twofold rotational symmetry. The two six-membered O-heterocycles adopt chair conformations through a shared spiro-carbon atom that...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2015
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4384547/ https://www.ncbi.nlm.nih.gov/pubmed/25878866 http://dx.doi.org/10.1107/S2056989015001206 |
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author | Chen, Liang Li, Zhengyi Jin, Linlin Sun, Xiaoqiang Wang, Zhiming |
author_facet | Chen, Liang Li, Zhengyi Jin, Linlin Sun, Xiaoqiang Wang, Zhiming |
author_sort | Chen, Liang |
collection | PubMed |
description | The title compound, C(19)H(16)F(4)O(4), was prepared by the condensation reaction of 2,6-difluorobenzaldehyde and pentaerythritol. The whole molecule is generated by twofold rotational symmetry. The two six-membered O-heterocycles adopt chair conformations through a shared spiro-carbon atom that is located on the crystallographic twofold rotation axis. In this conformation, the two aromatic rings are located at the equatorial positions of the O-heterocycles. The conformation of this doubly substituted tetraoxaspiro system is chiral. In the crystal, molecules are linked by C—H⋯O hydrogen bonds, forming layers parallel to (100). These layers are linked by C—H⋯F hydrogen bonds into a three-dimensional structure. |
format | Online Article Text |
id | pubmed-4384547 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2015 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-43845472015-04-15 Crystal structure of rac-3,9-bis(2,6-difluorophenyl)-2,4,8,10-tetraoxaspiro[5.5]undecane Chen, Liang Li, Zhengyi Jin, Linlin Sun, Xiaoqiang Wang, Zhiming Acta Crystallogr E Crystallogr Commun Data Reports The title compound, C(19)H(16)F(4)O(4), was prepared by the condensation reaction of 2,6-difluorobenzaldehyde and pentaerythritol. The whole molecule is generated by twofold rotational symmetry. The two six-membered O-heterocycles adopt chair conformations through a shared spiro-carbon atom that is located on the crystallographic twofold rotation axis. In this conformation, the two aromatic rings are located at the equatorial positions of the O-heterocycles. The conformation of this doubly substituted tetraoxaspiro system is chiral. In the crystal, molecules are linked by C—H⋯O hydrogen bonds, forming layers parallel to (100). These layers are linked by C—H⋯F hydrogen bonds into a three-dimensional structure. International Union of Crystallography 2015-01-24 /pmc/articles/PMC4384547/ /pubmed/25878866 http://dx.doi.org/10.1107/S2056989015001206 Text en © Chen et al. 2015 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 | Data Reports Chen, Liang Li, Zhengyi Jin, Linlin Sun, Xiaoqiang Wang, Zhiming Crystal structure of rac-3,9-bis(2,6-difluorophenyl)-2,4,8,10-tetraoxaspiro[5.5]undecane |
title | Crystal structure of rac-3,9-bis(2,6-difluorophenyl)-2,4,8,10-tetraoxaspiro[5.5]undecane |
title_full | Crystal structure of rac-3,9-bis(2,6-difluorophenyl)-2,4,8,10-tetraoxaspiro[5.5]undecane |
title_fullStr | Crystal structure of rac-3,9-bis(2,6-difluorophenyl)-2,4,8,10-tetraoxaspiro[5.5]undecane |
title_full_unstemmed | Crystal structure of rac-3,9-bis(2,6-difluorophenyl)-2,4,8,10-tetraoxaspiro[5.5]undecane |
title_short | Crystal structure of rac-3,9-bis(2,6-difluorophenyl)-2,4,8,10-tetraoxaspiro[5.5]undecane |
title_sort | crystal structure of rac-3,9-bis(2,6-difluorophenyl)-2,4,8,10-tetraoxaspiro[5.5]undecane |
topic | Data Reports |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4384547/ https://www.ncbi.nlm.nih.gov/pubmed/25878866 http://dx.doi.org/10.1107/S2056989015001206 |
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