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Crystal structure of 2-(4-methylphenyl)-2-oxo-1-(phenyliodonio)-1-(triphenylarsonio)ethanid tetrafluoroborate solved from X-ray powder data

The crystal structure of 2-(4-methylphenyl)-2-oxo-1-(phenyliodonio)-1-(triphenylarsonio)ethanid tetrafluoroborate, C 33 H 27 AsIO+BF 4 - , was solved and refined from laboratory X-ray powder diffraction data in combination with a DFT calculation (Co K α1 , a =24.427(2) Å, b = 13.3412(18) Å, c =22....

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Bibliographic Details
Main Authors: Mironov, Andrei V. (Author) , Chernyshev, Vladimir V. (Author) , Matveeva, Elena D. (Author) , Podrugina, Tatyana A. (Author) , Alferova, Vera A. (Author) , Gleiter, Rolf (Author) , Zefirov, Nikolai S. (Author)
Format: Article (Journal)
Language:English
Published: 21. Mai 2013
In: Zeitschrift für Kristallographie. Crystalline materials
Year: 2013, Volume: 228, Issue: 5, Pages: 255-258
ISSN:2196-7105
DOI:10.1524/zkri.2013.1566
Online Access:Verlag, lizenzpflichtig, Volltext: https://doi.org/10.1524/zkri.2013.1566
Verlag, lizenzpflichtig, Volltext: https://www.degruyterbrill.com/document/doi/10.1524/zkri.2013.1566/html
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Author Notes:Andrei V. Mironov, Vladimir V. Chernyshev, Elena D. Matveeva, Tatyana A. Podrugina, Vera A. Alferova, Rolf Gleiter und Nikolai S. Zefirov
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Summary:The crystal structure of 2-(4-methylphenyl)-2-oxo-1-(phenyliodonio)-1-(triphenylarsonio)ethanid tetrafluoroborate, C 33 H 27 AsIO+BF 4 - , was solved and refined from laboratory X-ray powder diffraction data in combination with a DFT calculation (Co K α1 , a =24.427(2) Å, b = 13.3412(18) Å, c =22.399(2) Å, β = 119.49(2)°, S.G. C2/c , R p / R wp = 0.030/0.039). The main features of the C 33 H 27 AsIO+BF 4 - structure are similar to those reported previously for arsenium and phosphorous organic compounds. The distinctive features are short I … O and I … F (2.743(19) and 2.916(17) Å, respectively) intermolecular contacts, also observed previously in the same type of compound, refined from single crystal data
Item Description:Gesehen am 25.05.2021
Physical Description:Online Resource
ISSN:2196-7105
DOI:10.1524/zkri.2013.1566

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