Tetranitromethane: A Nightmare of Molecular Flexibility in the Gaseous and Solid States

Vishnevskiy Y, Tikhonov DS, Schwabedissen J, Stammler H-G, Moll R, Krumm B, Klapoetke TM, Mitzel NW (2017)
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION 56(32): 9619-9623.

Zeitschriftenaufsatz | Veröffentlicht | Englisch
 
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Autor/in
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Abstract / Bemerkung
After numerous attempts over the last seven decades to obtain a structure for the simple, highly symmetric molecule tetranitromethane (C(NO2)(4), TNM) that is consistent with results from diffraction experiments and spectroscopic analysis, the structure has now been determined in the gas phase and the solid state. For the gas phase, a new approach based on a four-dimensional dynamic model for describing the correlated torsional dynamics of the four C-NO2 units was necessary to describe the experimental gas-phase electron diffraction intensities. A model describing a highly disordered high-temperature crystalline phase was also established, and the structure of an ordered low-temperature phase was determined by X-ray diffraction. TNM is a prime example of molecular flexibility, bringing structural methods to the limits of their applicability.
Stichworte
gas-phase electron diffraction; molecular dynamics; molecular structure; tetranitromethane; X-ray diffraction
Erscheinungsjahr
2017
Zeitschriftentitel
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION
Band
56
Ausgabe
32
Seite(n)
9619-9623
ISSN
1433-7851
eISSN
1521-3773
Page URI
https://pub.uni-bielefeld.de/record/2913987

Zitieren

Vishnevskiy Y, Tikhonov DS, Schwabedissen J, et al. Tetranitromethane: A Nightmare of Molecular Flexibility in the Gaseous and Solid States. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION. 2017;56(32):9619-9623.
Vishnevskiy, Y., Tikhonov, D. S., Schwabedissen, J., Stammler, H. - G., Moll, R., Krumm, B., Klapoetke, T. M., et al. (2017). Tetranitromethane: A Nightmare of Molecular Flexibility in the Gaseous and Solid States. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 56(32), 9619-9623. doi:10.1002/anie.201704396
Vishnevskiy, Y., Tikhonov, D. S., Schwabedissen, J., Stammler, H. - G., Moll, R., Krumm, B., Klapoetke, T. M., and Mitzel, N. W. (2017). Tetranitromethane: A Nightmare of Molecular Flexibility in the Gaseous and Solid States. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION 56, 9619-9623.
Vishnevskiy, Y., et al., 2017. Tetranitromethane: A Nightmare of Molecular Flexibility in the Gaseous and Solid States. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 56(32), p 9619-9623.
Y. Vishnevskiy, et al., “Tetranitromethane: A Nightmare of Molecular Flexibility in the Gaseous and Solid States”, ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, vol. 56, 2017, pp. 9619-9623.
Vishnevskiy, Y., Tikhonov, D.S., Schwabedissen, J., Stammler, H.-G., Moll, R., Krumm, B., Klapoetke, T.M., Mitzel, N.W.: Tetranitromethane: A Nightmare of Molecular Flexibility in the Gaseous and Solid States. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION. 56, 9619-9623 (2017).
Vishnevskiy, Yury, Tikhonov, Denis S., Schwabedissen, Jan, Stammler, Hans-Georg, Moll, Richard, Krumm, Burkhard, Klapoetke, Thomas M., and Mitzel, Norbert W. “Tetranitromethane: A Nightmare of Molecular Flexibility in the Gaseous and Solid States”. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION 56.32 (2017): 9619-9623.

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