Synthesis, non-spherical structure refinement and Hirshfeld surface analysis of racemic 2,2′-diisobutoxy-1,1′-binaphthalene

Synthesis, non-spherical structure refinement and Hirshfeld surface analysis of racemic 2,2′-diisobutoxy-1,1′-binaphthalene

In the racemic title compound, C 28 H 30 O 2 , the naphthyl ring systems subtend a dihedral angle of 68.59 (1)° and the molecular conformation is consolidated by a pair of intramolecular C—H...π contacts. The crystal packing features a weak C—H...π contact and van der Waals forces. A Hirshfeld surfa...

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Veröffentlicht in:Acta crystallographica. Section E, Crystallographic communications Crystallographic communications, 2024-10, Vol.80 (10), p.1044-1048
Hauptverfasser: Coulibaly, Pénayori Marie-Aimée, Ziki, Eric, Bisseyou, Yvon Bibila Mayaya, Camara, Tchambaga Etienne, Coulibaly, Souleymane, Sissouma, Drissa
Format: Artikel
Sprache:eng
Schlagworte:
1–1′-binaphthyl derivative
crystal structure
hirshfeld surface analysis
non-spherical refinement
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Zusammenfassung:In the racemic title compound, C 28 H 30 O 2 , the naphthyl ring systems subtend a dihedral angle of 68.59 (1)° and the molecular conformation is consolidated by a pair of intramolecular C—H...π contacts. The crystal packing features a weak C—H...π contact and van der Waals forces. A Hirshfeld surface analysis of the crystal structure reveals that the most significant contributions are from H...H (73.2%) and C...H/H...C (21.2%) contacts.
ISSN:2056-9890
2056-9890
DOI:10.1107/S2056989024009101