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Polymorphism and Modulation of Para-Substituted l-Phenylalanine
[Image: see text] The crystal structure of para-methyl-l-phenylalanine at 230 K resembles that of the para-fluorinated analogue from the literature but is commensurately modulated with seven molecules in the asymmetric unit (Z′ = 7). At 100 K, the superstructure loses its modulation, leading to a un...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
American Chemical
Society
2017
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5721337/ https://www.ncbi.nlm.nih.gov/pubmed/29234239 http://dx.doi.org/10.1021/acs.cgd.7b00747 |
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author | Sögütoglu, Leyla-Cann Lutz, Martin Meekes, Hugo de Gelder, René Vlieg, Elias |
author_facet | Sögütoglu, Leyla-Cann Lutz, Martin Meekes, Hugo de Gelder, René Vlieg, Elias |
author_sort | Sögütoglu, Leyla-Cann |
collection | PubMed |
description | [Image: see text] The crystal structure of para-methyl-l-phenylalanine at 230 K resembles that of the para-fluorinated analogue from the literature but is commensurately modulated with seven molecules in the asymmetric unit (Z′ = 7). At 100 K, the superstructure loses its modulation, leading to a unit cell with Z′ = 1, with clear disorder in the phenyl ring orientations. The methyl-substituent in para-methyl-l-phenylalanine has, in contrast to fluorine, no polar interactions with protons of neighboring molecules, which might allow for the well-defined modulation of the crystal structure at 230 K. |
format | Online Article Text |
id | pubmed-5721337 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2017 |
publisher | American Chemical
Society |
record_format | MEDLINE/PubMed |
spelling | pubmed-57213372017-12-10 Polymorphism and Modulation of Para-Substituted l-Phenylalanine Sögütoglu, Leyla-Cann Lutz, Martin Meekes, Hugo de Gelder, René Vlieg, Elias Cryst Growth Des [Image: see text] The crystal structure of para-methyl-l-phenylalanine at 230 K resembles that of the para-fluorinated analogue from the literature but is commensurately modulated with seven molecules in the asymmetric unit (Z′ = 7). At 100 K, the superstructure loses its modulation, leading to a unit cell with Z′ = 1, with clear disorder in the phenyl ring orientations. The methyl-substituent in para-methyl-l-phenylalanine has, in contrast to fluorine, no polar interactions with protons of neighboring molecules, which might allow for the well-defined modulation of the crystal structure at 230 K. American Chemical Society 2017-11-08 2017-12-06 /pmc/articles/PMC5721337/ /pubmed/29234239 http://dx.doi.org/10.1021/acs.cgd.7b00747 Text en Copyright © 2017 American Chemical Society This is an open access article published under a Creative Commons Non-Commercial No Derivative Works (CC-BY-NC-ND) Attribution License (http://pubs.acs.org/page/policy/authorchoice_ccbyncnd_termsofuse.html) , which permits copying and redistribution of the article, and creation of adaptations, all for non-commercial purposes. |
spellingShingle | Sögütoglu, Leyla-Cann Lutz, Martin Meekes, Hugo de Gelder, René Vlieg, Elias Polymorphism and Modulation of Para-Substituted l-Phenylalanine |
title | Polymorphism and Modulation of Para-Substituted l-Phenylalanine |
title_full | Polymorphism and Modulation of Para-Substituted l-Phenylalanine |
title_fullStr | Polymorphism and Modulation of Para-Substituted l-Phenylalanine |
title_full_unstemmed | Polymorphism and Modulation of Para-Substituted l-Phenylalanine |
title_short | Polymorphism and Modulation of Para-Substituted l-Phenylalanine |
title_sort | polymorphism and modulation of para-substituted l-phenylalanine |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5721337/ https://www.ncbi.nlm.nih.gov/pubmed/29234239 http://dx.doi.org/10.1021/acs.cgd.7b00747 |
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