Cargando…
The halogen-bonded adduct 1,4-bis(pyridin-4-yl)buta-1,3-diyne–1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluoro-1,8-diiodooctane (1/1)
In the crystal structure of the title compound, C(8)F(16)I(2)·C(14)H(8)N(2), the molecules form infinite chains parallel to [2-11] through two symmetry-independent C—I⋯N halogen bonds (XBs). As commonly found, the perfluoroalkyl molecules segregate from the hydrocarbon ones, forming a layered st...
Autores principales: | , , , , |
---|---|
Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2013
|
Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3588426/ https://www.ncbi.nlm.nih.gov/pubmed/23476525 http://dx.doi.org/10.1107/S1600536813001888 |
_version_ | 1782261563055407104 |
---|---|
author | Cavallo, Gabriella Marras, Giovanni Metrangolo, Pierangelo Pilati, Tullio Terraneo, Giancarlo |
author_facet | Cavallo, Gabriella Marras, Giovanni Metrangolo, Pierangelo Pilati, Tullio Terraneo, Giancarlo |
author_sort | Cavallo, Gabriella |
collection | PubMed |
description | In the crystal structure of the title compound, C(8)F(16)I(2)·C(14)H(8)N(2), the molecules form infinite chains parallel to [2-11] through two symmetry-independent C—I⋯N halogen bonds (XBs). As commonly found, the perfluoroalkyl molecules segregate from the hydrocarbon ones, forming a layered structure. Apart from the XBs, the only contact below the sum of van der Waals radii is a weak H⋯F contact. The topology of the network is a nice example of the paradigm of the expansion of ditopic starting modules; the XB leads to the construction of infinite supramolecular chains along [2-11] formed by alternating XB donors and acceptors. |
format | Online Article Text |
id | pubmed-3588426 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2013 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-35884262013-03-08 The halogen-bonded adduct 1,4-bis(pyridin-4-yl)buta-1,3-diyne–1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluoro-1,8-diiodooctane (1/1) Cavallo, Gabriella Marras, Giovanni Metrangolo, Pierangelo Pilati, Tullio Terraneo, Giancarlo Acta Crystallogr Sect E Struct Rep Online Organic Papers In the crystal structure of the title compound, C(8)F(16)I(2)·C(14)H(8)N(2), the molecules form infinite chains parallel to [2-11] through two symmetry-independent C—I⋯N halogen bonds (XBs). As commonly found, the perfluoroalkyl molecules segregate from the hydrocarbon ones, forming a layered structure. Apart from the XBs, the only contact below the sum of van der Waals radii is a weak H⋯F contact. The topology of the network is a nice example of the paradigm of the expansion of ditopic starting modules; the XB leads to the construction of infinite supramolecular chains along [2-11] formed by alternating XB donors and acceptors. International Union of Crystallography 2013-02-02 /pmc/articles/PMC3588426/ /pubmed/23476525 http://dx.doi.org/10.1107/S1600536813001888 Text en © Cavallo et al. 2013 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 | Organic Papers Cavallo, Gabriella Marras, Giovanni Metrangolo, Pierangelo Pilati, Tullio Terraneo, Giancarlo The halogen-bonded adduct 1,4-bis(pyridin-4-yl)buta-1,3-diyne–1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluoro-1,8-diiodooctane (1/1) |
title | The halogen-bonded adduct 1,4-bis(pyridin-4-yl)buta-1,3-diyne–1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluoro-1,8-diiodooctane (1/1) |
title_full | The halogen-bonded adduct 1,4-bis(pyridin-4-yl)buta-1,3-diyne–1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluoro-1,8-diiodooctane (1/1) |
title_fullStr | The halogen-bonded adduct 1,4-bis(pyridin-4-yl)buta-1,3-diyne–1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluoro-1,8-diiodooctane (1/1) |
title_full_unstemmed | The halogen-bonded adduct 1,4-bis(pyridin-4-yl)buta-1,3-diyne–1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluoro-1,8-diiodooctane (1/1) |
title_short | The halogen-bonded adduct 1,4-bis(pyridin-4-yl)buta-1,3-diyne–1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluoro-1,8-diiodooctane (1/1) |
title_sort | halogen-bonded adduct 1,4-bis(pyridin-4-yl)buta-1,3-diyne–1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluoro-1,8-diiodooctane (1/1) |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3588426/ https://www.ncbi.nlm.nih.gov/pubmed/23476525 http://dx.doi.org/10.1107/S1600536813001888 |
work_keys_str_mv | AT cavallogabriella thehalogenbondedadduct14bispyridin4ylbuta13diyne1122334455667788hexadecafluoro18diiodooctane11 AT marrasgiovanni thehalogenbondedadduct14bispyridin4ylbuta13diyne1122334455667788hexadecafluoro18diiodooctane11 AT metrangolopierangelo thehalogenbondedadduct14bispyridin4ylbuta13diyne1122334455667788hexadecafluoro18diiodooctane11 AT pilatitullio thehalogenbondedadduct14bispyridin4ylbuta13diyne1122334455667788hexadecafluoro18diiodooctane11 AT terraneogiancarlo thehalogenbondedadduct14bispyridin4ylbuta13diyne1122334455667788hexadecafluoro18diiodooctane11 AT cavallogabriella halogenbondedadduct14bispyridin4ylbuta13diyne1122334455667788hexadecafluoro18diiodooctane11 AT marrasgiovanni halogenbondedadduct14bispyridin4ylbuta13diyne1122334455667788hexadecafluoro18diiodooctane11 AT metrangolopierangelo halogenbondedadduct14bispyridin4ylbuta13diyne1122334455667788hexadecafluoro18diiodooctane11 AT pilatitullio halogenbondedadduct14bispyridin4ylbuta13diyne1122334455667788hexadecafluoro18diiodooctane11 AT terraneogiancarlo halogenbondedadduct14bispyridin4ylbuta13diyne1122334455667788hexadecafluoro18diiodooctane11 |