Quantifying intermolecular interactions for isoindole derivatives: substituent effect vs. crystal packing

Autor: Carsten Paulmann, Birger Dittrich, Magdalena Ciechańska, Lilianna Chęcińska, Magdalena Małecka, Julian J. Holstein, Andrzej Jóźwiak
Jazyk: angličtina
Rok vydání: 2018
Předmět:
Zdroj: Zeitschrift für Kristallographie / Crystalline materials Crystalline materials : CM CM 233(9-10), 675-687 (2018). doi:10.1515/zkri-2018-2076
DOI: 10.3204/pubdb-2018-05909
Popis: Zeitschrift für Kristallographie / Crystalline materials Crystalline materials : CM CM 233(9-10), 675 - 687 (2018). doi:10.1515/zkri-2018-2076
The aim of the study was to examine noncovalent interactions in considerably different crystal packings of three isoindole compounds. Their structures were compared to three other closely-related derivatives described earlier in the literature. Here we discuss the crystal structures in the context of the hydrogen-bonded motifs and other weak interactions. The hierarchy of investigated intermolecular interactions was examined in a quantitative manner through pairwise interaction energies and energy framework analysis.
Published by De Gruyter, Berlin
Databáze: OpenAIRE
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