Abstract
The crystal and molecular structures of the title host compound (I), C35H26O, and its inclusion complexes with water (II), C35H26O·H2O and dimethylsulphoxide (III), C35H26O·C2H6OS are reported. (I) is monoclinicC2/c,a = 9.725(1),b = 20.031(3),c = 26.545(3) Å, β = 90.60(1)0,V = 5170 Å3,Z = 8; (II) is triclinic,\(P\bar 1\),a = 10.206(1),b = 10.324(2),c = 14.425(2) Å, α = 101.68(1), β = 89.92(2), γ = 116.34(1)0,V = 1327 Å3,Z = 2; (III) is monoclinicP21/n,a = 17.832(5),b = 10.109(3),c = 17.901(5) Å, β = 111.93(2)0,V = 2993 Å3,Z =4. The structures were solved by direct methods and refined to final residuals of 0.045, 0.048, and 0.071, respectively. Thermal analysis of the complexes corroborates the crystallographic results.
Article PDF
Similar content being viewed by others
Avoid common mistakes on your manuscript.
References
F. Toda: inMolecular Inclusion and Molecular Recognition in Clathrates, Vol. 1, ed. E. Weber, Topics in Current Chemistry, Vol. 140, Springer Verlag, Berlin-Heidelberg-New York (1987).
F. Toda: inMolecular Inclusion and Molecular Recognition in Clathrates, Vol. 2, ed. E. Weber, Topics in Current Chemistry, Vol. 149, Springer Verlag, Berlin-Heidelberg-New York (1988).
D. R. Bond, L. R. Nassimbeni, and F. Toda:J. Incl. Phenom. 7, 623 (1989).
D. R. Bond, L. R. Nassimbeni, and F. Toda:J. Crystallogr. Spectrosc. Res. 19, 847 (1989).
D. R. Bond, M. R. Caira, G. A. Harvey, L. R. Nassimbeni, and F. Toda:Acta Crystallogr. B46, 771 (1990).
M. R. Caira, L. R. Nassimbeni, M. L. Niven, W-D. Schubert, E. Weber, and N. Dorpinghaus:J. Chem. Soc. Perkin Trans. 2, 2129 (1990).
D. R. Bond, L. Johnson, L. R. Nassimbeni, and F. Toda:J. Solid State Chem. 92, 68 (1991).
K. Ziegler and B. Schmell:Ann. Chem. 445, 266 (1925).
G. M. Sheldrick: ‘The SHELX-S Program System’, inCrystallographic Computing 3, eds. G. M. Sheldrick, C. Kruger and R. Goddard, Oxford University Press, p. 175 (1985).
G. M. Sheldrick: ‘The SHELX-76 program system’, inComputing in Crystallography, eds. H. Schenk, R. Olthof-Hazekamp, H. van Koningsveld and G. C. Bassi, Delft University Press, p. 34 (1978).
D. R. Bond, S. A. Bourne, L. R. Nassimbeni, and F. Toda:J. Crystallogr. Spectrosc. Res. 19, 809 (1989).
D. T. Cromer and J. B. Mann:Acta Crystallogr. A24, 321 (1968).
R. F. Stewart, E. R. Davidson, and W. T. Simpson:J. Chem. Phys. 42, 3175 (1965).
D. T. Cromer and D. Liberman:J. Chem. Phys. 53, 1891 (1970).
M. Nardelli:Comput. Chem. 7, 95 (1983).
W. D. S. Motherwell: ‘The PLUTO program for molecular drawings’, Cambridge University, unpublished.
S. A. Bourne, L. Johnson, C. Marais, L. R. Nassimbeni, E. Weber, K. Skobridis, and F. Toda:J. Chem. Soc., Perkin Trans. 2, 1707 (1991).
F. H. Allen, O. Kennard, D. G. Watson, L. Brammer, A. G. Orpen, and R. Taylor:J. Chem. Soc., Perkin Trans. 2, S1 (1987).
Author information
Authors and Affiliations
Rights and permissions
About this article
Cite this article
Bourne, S.A., Nassimbeni, L.R., Niven, M.L. et al. Complexation with hydroxy host compounds, part 5. Structures and thermal analyses of 1,2,3,4,5-pentaphenylcyclopenta-2,4-dien-1-ol and its inclusion compounds with water and dimethylsulphoxide. J Incl Phenom Macrocycl Chem 13, 301–310 (1992). https://doi.org/10.1007/BF01133229
Received:
Accepted:
Issue Date:
DOI: https://doi.org/10.1007/BF01133229