Solid-State Structural Properties of Alloxazine Determined from Powder XRD Data in Conjunction with DFT-D Calculations and Solid-State NMR Spectroscopy: Unraveling the Tautomeric Identity and Pathways for Tautomeric Interconversion.

Smalley, Christopher J H; Logsdail, Andrew J; Hughes, Colan E; Iuga, Dinu; Young, Mark T; Harris, Kenneth D M

Smalley, Christopher J H; Logsdail, Andrew J; Hughes, Colan E; Iuga, Dinu; Young, Mark T; Harris, Kenneth D M.

Afiliação

Smalley CJH; School of Chemistry, Cardiff University, Park Place, Cardiff CF10 3AT, Wales, United Kingdom.
Logsdail AJ; Cardiff Catalysis Institute, School of Chemistry, Cardiff University, Park Place, Cardiff CF10 3AT, Wales, United Kingdom.
Hughes CE; School of Chemistry, Cardiff University, Park Place, Cardiff CF10 3AT, Wales, United Kingdom.
Iuga D; Department of Physics, University of Warwick, Coventry CV4 7AL, England, United Kingdom.
Young MT; School of Biosciences, Cardiff University, Cardiff CF10 3AX, Wales, United Kingdom.
Harris KDM; School of Chemistry, Cardiff University, Park Place, Cardiff CF10 3AT, Wales, United Kingdom.

Cryst Growth Des ; 22(1): 524-534, 2022 Jan 05.

Article em En | MEDLINE | ID: mdl-35024003

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Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Idioma: En Ano de publicação: 2022 Tipo de documento: Article

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Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Idioma: En Ano de publicação: 2022 Tipo de documento: Article