Crystal Structure of Benzene at −3° C.

作者: E. G. COX , J. A. S. SMITH

DOI: 10.1038/173075A0

关键词:

摘要: A PRELIMINARY determination1 of the crystal structure benzene at −22° C. showed that crystals are orthorhombic. space-group Pbca, with four centro-symmetrical molecules in unit cell, and normals to planes roughly perpendicular b-axis inclined about 50° c-axis. We have now completed first stage refinement −3° Crystals were grown Lindemann glass tubes wall thickness 0.05 mm. bore 0.36 by method Keesom Taconis2 as modified later workers3. 288 independent reflexion intensities representing 56 per cent total possible copper radiation estimated visually from oscillation photographs all three principal axes. Chromium-K was used obtain accurate values cell dimensions Straumanis method; revised a = 7.460, b 9.666 c 7.034 A.

参考文章(6)
B. Stoicheff, The Rotational Raman Spectrum of Benzene Vapor The Journal of Chemical Physics. ,vol. 21, pp. 1410- 1411 ,(1953) , 10.1063/1.1699247
The Crystalline Structure of Benzene Proceedings of The Royal Society A: Mathematical, Physical and Engineering Sciences. ,vol. 135, pp. 491- 498 ,(1932) , 10.1098/RSPA.1932.0047
W.H. Keesom, K.W. Taconis, An x-ray goniometer for the investigation of the crystal structure of solidified gases Physica D: Nonlinear Phenomena. ,vol. 2, pp. 463- 471 ,(1935) , 10.1016/S0031-8914(35)90116-1
F. R. Ahmed, D. W. J. Cruickshank, Crystallographic calculations on the Manchester University electronic digital computer (Mark II) Acta Crystallographica. ,vol. 6, pp. 765- 769 ,(1953) , 10.1107/S0365110X53002180
H. S. Kaufman, I. Fankuchen, A low temperature single crystal X-ray diffraction technique. Review of Scientific Instruments. ,vol. 20, pp. 733- 734 ,(1949) , 10.1063/1.1741367
The accuracy of atomic co-ordinates derived from Fourier series in X-ray structure analysis Proceedings of The Royal Society A: Mathematical, Physical and Engineering Sciences. ,vol. 188, pp. 77- 92 ,(1946) , 10.1098/RSPA.1946.0098