A library of dimeric and trimeric phthalonitriles linked by a single aromatic ring: comparative structural and DFT investigations

A library of five phthalonitriles, dimeric or trimeric, all connected by an aromatic spacer (catechol, resorcinol, hydroquinone, phloroglucinol and catechol with two tert -butyl moieties), was selected to be comparatively studied from a structural point of view. Hirshfeld surface analysis and DFT ca...

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Bibliographic Details
Published in:CrystEngComm 2016-01, Vol.18 (8), p.1416-1426
Main Authors: Köç, Muzaffer, Zorlu, Yunus, ci, Ümit, Berber, Sava, Ahsen, Vefa, Dumoulin, Fabienne
Format: Article
Language:English
Subjects:
Aromatic compounds
Catechol
Hydroquinone
Libraries
Mathematical analysis
Phloroglucinol
Spacers
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Summary:A library of five phthalonitriles, dimeric or trimeric, all connected by an aromatic spacer (catechol, resorcinol, hydroquinone, phloroglucinol and catechol with two tert -butyl moieties), was selected to be comparatively studied from a structural point of view. Hirshfeld surface analysis and DFT calculations were performed as well. A library of five phthalonitriles, dimeric or trimeric, all connected by an aromatic spacer, was selected to be comparatively studied from a structural point of view.
ISSN:1466-8033
1466-8033
DOI:10.1039/c5ce02261d