Ambiguous structure determination from powder data: four different structural models of 4,11-di­fluoro­quinacridone with similar X-ray powder patterns, fit to the PDF, SSNMR and DFT-D

Four different structural models, which all fit the same X-ray powder pattern, were obtained in the structure determination of 4,11-di­fluoro­quinacridone (C(20)H(10)N(2)O(2)F(2)) from unindexed X-ray powder data by a global fit. The models differ in their lattice parameters, space groups, Z, Z′, mo...

Descripción completa

Detalles Bibliográficos
Autores principales: Schlesinger, Carina, Fitterer, Arnd, Buchsbaum, Christian, Habermehl, Stefan, Chierotti, Michele R., Nervi, Carlo, Schmidt, Martin U.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2022
Materias:
Research Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9252154/
https://www.ncbi.nlm.nih.gov/pubmed/35844476
http://dx.doi.org/10.1107/S2052252522004237

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9252154/
https://www.ncbi.nlm.nih.gov/pubmed/35844476
http://dx.doi.org/10.1107/S2052252522004237

Ejemplares similares