1,4,6,9-Tetraoxa-5λ4-selena-spiro[4.4]nonane - A Combined Theoretical and Experimental Study

The symmetric spiro‐selenurane derived from ethylene glycol, 1,4,6,9‐tetraoxa‐5λ4‐selena‐spiro[4.4]nonane, was prepared from selenium tetrachloride and ethylene glycol and its molecular structure was determined by single crystal X‐ray diffraction. NBO analyses for the title compound and a related co...

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Veröffentlicht in:	Zeitschrift für anorganische und allgemeine Chemie (1950) 2008-07, Vol.634 (8), p.1393-1396
Hauptverfasser:	Betz, Richard, Pfister, Maximilian, Reichvilser, Moritz M., Klüfers, Peter
Format:	Artikel
Sprache:	eng
Schlagworte:	Bond theory Density functional calculations NBO analysis Selenium Structure elucidation
Online-Zugang:	Volltext
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Zusammenfassung:	The symmetric spiro‐selenurane derived from ethylene glycol, 1,4,6,9‐tetraoxa‐5λ4‐selena‐spiro[4.4]nonane, was prepared from selenium tetrachloride and ethylene glycol and its molecular structure was determined by single crystal X‐ray diffraction. NBO analyses for the title compound and a related compound were conducted to assess the role of the stereochemical active lone pair on the selenium atom on the structure.
ISSN:	0044-2313 1521-3749
DOI:	10.1002/zaac.200800097