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Gärtner, Stefanie ; Gärtner, Tobias ; Gschwind, Ruth-Maria ; Korber, Nikolaus

About the polymorphism of Li(C${\sb 4}$H${\sb 8}$O)${\sb 3}$I: crystal structures of trigonal and tetragonal polymorphs

Gärtner, Stefanie, Gärtner, Tobias, Gschwind, Ruth-Maria und Korber, Nikolaus (2014) About the polymorphism of Li(C${\sb 4}$H${\sb 8}$O)${\sb 3}$I: crystal structures of trigonal and tetragonal polymorphs. Acta Crystallographica Section E 70 (12), S. 555-558.

Veröffentlichungsdatum dieses Volltextes: 16 Dez 2014 16:45
Artikel


Zusammenfassung

Two new trigonal and tetra­gonal polymorphs of the title compound, iodido­tris­(tetra­hydro­furan-[kappa]O)lithium, are presented, which both include the isolated ion pair Li(THF)3+·I-. One Li-I ion contact and three tetra­hydro­furan (THF) mol­ecules complete the tetra­hedral coordination of the lithium cation. The three-dimensional arrangement in the two polymorphs differs notably. In the ...

Two new trigonal and tetra­gonal polymorphs of the title compound, iodido­tris­(tetra­hydro­furan-[kappa]O)lithium, are presented, which both include the isolated ion pair Li(THF)3+·I-. One Li-I ion contact and three tetra­hydro­furan (THF) mol­ecules complete the tetra­hedral coordination of the lithium cation. The three-dimensional arrangement in the two polymorphs differs notably. In the trigonal structure, the ion pair is located on a threefold rotation axis of space group P-3 and only one THF mol­ecule is present in the asymmetric unit. In the crystal, strands of ion pairs parallel to [001] are observed with an eclipsed conformation of the THF mol­ecules relative to the Li...I axis of two adjacent ion pairs. In contrast, the tetra­gonal polymorph shows a much larger unit cell in which all atoms are located on general positions of the space group I41cd. The resulting three-dimensional arrangement shows helical chains of ion pairs parallel to [001]. Apart from van der Waals contacts, no remarkable inter­molecular forces are present between the isolated ion pairs in both structures.



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Details

DokumentenartArtikel
Titel eines Journals oder einer ZeitschriftActa Crystallographica Section E
Band:70
Nummer des Zeitschriftenheftes oder des Kapitels:12
Seitenbereich:S. 555-558
DatumDezember 2014
InstitutionenChemie und Pharmazie > Institut für Anorganische Chemie > Arbeitskreis Prof. Dr. Nikolaus Korber
Identifikationsnummer
WertTyp
10.1107/S160053681402529XDOI
Stichwörter / Keywordscrystal structure ; polymorphism ; THF solvate ; lithium complexes
Dewey-Dezimal-Klassifikation500 Naturwissenschaften und Mathematik > 540 Chemie
StatusVeröffentlicht
BegutachtetJa, diese Version wurde begutachtet
An der Universität Regensburg entstandenJa
URN der UB Regensburgurn:nbn:de:bvb:355-epub-310434
Dokumenten-ID31043

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