Chemical Research in Chinese Universities ›› 2004, Vol. 20 ›› Issue (6): 778-780.

• Articles • Previous Articles     Next Articles

Molecular Chirality and Chiral Superlattice in Crystal of Tetrakis[(pyrrol-1-yl)methyl]methane

XU Wei1, LU Yin-xiang1, LIU Chun-ming1, LAN Bi-jian1, ZHOU Hui1, WANG Jing-mei2   

  1. 1. Department of Materials Science, Fudan University, Shanghai 200433, P. R. China;
    2. Research Center for Analysis and Measurement, Fudan University, Shanghai 200433, P. R. China
  • Received:2003-09-08 Online:2004-12-24 Published:2011-08-06
  • Supported by:

    Supported by the National Natural Science Foundation of China(No.60171008) and Shanghai Science and Technology Committee(No.0214nm005).

Abstract: The crystal structure of tetrakis[(pyrrol-1-yl)methyl]methane was determined by X-ray diffraction measurement, and the result shows that it belongs to monoclinic crystal system, space group is P21/n, with a=0.9284(3) nm, b=1.0950(6) nm, c=1.8749(8) nm; α=γ= 90.00(4)°, β=103.63(3)°, V=1.8523(14) nm3, Z=4, ρcalcd.=1.192 kg/m3, μ=0.072 nm-1, F(000)=712, R1=0.0854, wR2=0.1884. It has been found that the molecules exist in two enantiomeric states. Enantioselective self-assemblies such as one-dimensional molecular stacks in a single handedness, homochiral monolayers and a chiral superlattice are specified in this racemic crystal. In addition, a simple technique is advocated to distinguish chiral states from tetrahedral molecules in the solid state. The present R/S nomenclature of the tetracooradinated carbon centers is used solely for its convenience to distinguish the two enantiomeric states, but not used to determine the absolute configurations.

Key words: Achiral molecule, Racemic crystal, Central chirality, Enantioselective self-assembly, Chiral superlattice