Reinvestigation of the molecular structure of gaseousp‐benzoquinone by electron diffraction

作者: Kolbjo/rn Hagen , Kenneth Hedberg

DOI: 10.1063/1.1679786

关键词:

摘要: The molecular structure of gaseous p‐benzoquinone has been studied by electron diffraction at a nozzle‐tip temperature 110–125°C. molecule D2h symmetry to within experimental error. results for the more important distance (ra), bond angle, and rms amplitude (l) parameters are rC–H=1.089 A (0.011), rC=O=1.225 A (0.002), rC=C=1.344 A (0.003), rC–C=1.481 A (0.002), ∠C2C1C6=118.1° (0.3), ∠C3C2H=121.4° (assumed), lC–H=0.077 A (assumed), lC=O=0.0424 A (0.0020), lC=C=0.0446 A (0.0024), lC–C=0.0546 A (0.0024). These values in good agreement with those found an early electron‐diffraction study Swingle, except length carbon‐carbon double bond, excellent crystal Trotter.

参考文章(15)
Saul Patai, The Chemistry of the carbonyl group Interscience Publishers. ,(1966)
Kozo Kuchttsu, Tsutomu Fukuyama, Yonezo Morino, Average structures of butadiene, acrolein, and glyoxal determined by gas electron diffraction and spectroscopy Journal of Molecular Structure. ,vol. 1, pp. 463- 479 ,(1968) , 10.1016/0022-2860(68)87020-6
F. L. Hirshfeld, D. Rabinovich, Structure and electron density of 2,5‐dimethyl‐p‐benzoquinone Acta Crystallographica. ,vol. 23, pp. 989- 1000 ,(1967) , 10.1107/S0365110X67004177
Kozo Kuchitsu, Calculation of the Average Structure of Ethylene Journal of Chemical Physics. ,vol. 44, pp. 906- 911 ,(1966) , 10.1063/1.1726840
J. Trotter, A three-dimensional analysis of the crystal structure of p-benzoquinone Acta Crystallographica. ,vol. 13, pp. 86- 95 ,(1960) , 10.1107/S0365110X60000212
Grete Gundersen, Kenneth Hedberg, Molecular Structure of Thionyltetrafluoride, SOF4 The Journal of Chemical Physics. ,vol. 51, pp. 2500- 2507 ,(1969) , 10.1063/1.1672372
Vernon Plato, William D. Hartford, Kenneth Hedberg, Electron‐Diffraction Investigation of the Molecular Structure of Trifluoramine Oxide, F3NO The Journal of Chemical Physics. ,vol. 53, pp. 3488- 3494 ,(1970) , 10.1063/1.1674522
Kenneth Hedberg, Machio Iwasaki, Effect of Temperature on the Structure of Gaseous Molecules. Molecular Structure of PCl3 at 300° and 505°K The Journal of Chemical Physics. ,vol. 36, pp. 589- 594 ,(1962) , 10.1063/1.1732575