A thermodynamically consistent phase diagram of a trimorphic pharmaceutical, l-tyrosine ethyl ester, based on limited experimental data-Reference-Cited by-同舟云学术

A thermodynamically consistent phase diagram of a trimorphic pharmaceutical, l-tyrosine ethyl ester, based on limited experimental data

Published:2018 Issue:37 Volume:20 Page:24074-24087
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Nicolaï Béatrice¹²³⁴⁵,Barrio Maria⁶⁷⁸⁹¹⁰,Lloveras Pol⁶⁷⁸⁹¹⁰,Polian Alain¹¹¹²¹³¹⁴¹⁵,Itié Jean-Paul¹⁶¹⁷¹⁸⁵,Tamarit Josep-Lluis⁶⁷⁸⁹¹⁰^ORCID,Rietveld Ivo B.²¹⁹²⁰²¹⁵^ORCID

Affiliation:

1. Université Paris Sud

2. Faculté de Pharmacie

3. UMR8612 Institut Gallien

4. 92296 Châtenay-Malabry

5. France

6. Grup de Caracterització de Materials

7. Departament de Física and Barcelona Research Center in Multiscale Science and Engineering, Universitat Politècnica de Catalunya

8. EEBE

9. 08019 Barcelona

10. Spain

11. Sorbonne Université

12. CNRS UMR 7590

13. Institut de Minéralogie

14. de Physique des Matériaux et de Cosmochimie

15. 75005 Paris

16. Synchrotron SOLEIL

17. L'Orme des Merisiers Saint-Aubin

18. 91192 Gif-sur-Yvette

19. Université Paris Descartes

20. Université Sorbonne Paris Cité

21. 75006 Paris

Abstract

Step by step mapping of phase behaviour with thermodynamic support and feedback.

Funder

Consejo Superior de Investigaciones Científicas

Departament d'Innovació, Universitats i Empresa, Generalitat de Catalunya

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2018/CP/C8CP01813H

Reference51 articles.

1. J. Bernstein , Polymorphism in Molecular Crystals , Oxford University Press , Oxford UK , 2002

2. A strategy for predicting the crystal structures of flexible molecules: the polymorphism of phenobarbital

3. Combined crystal structure prediction and high-pressure crystallization in rational pharmaceutical polymorph screening

4. Report on the sixth blind test of organic crystal structure prediction methods

5. Conformational polymorphism. The influence of crystal structure on molecular conformation

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