Chem. J. Chinese Universities ›› 2011, Vol. 32 ›› Issue (6): 1305.

• Articles • Previous Articles     Next Articles

Synthesis and Crystal Structure of 3-Ferrocenyl-5-aryl-1-benzenesulfonyl Dihydropyrazole Derivatives

LI Chun-Yan2,3, ZHUO Ji-Bin2, XIE Li-Li1,2, LI Heng-Dong2, WANG Wen-Feng2, YUAN Yao-Feng1,2*   

  1. 1.  State Key Laboratory Breeding Base of Photocatalysis, Fuzhou University, Fuzhou 350002, China;
    2.  College of Chemistry and Chemical Engineering, Fuzhou University, Fuzhou 350108, China;
    3.  Faculty of Pharmacy, Fujian Medical University, Fuzhou, 350108, China
  • Received:2010-07-23 Revised:2010-10-08 Online:2011-06-10 Published:2011-05-10
  • Contact: YUAN Yao-Feng E-mail:yaofeng_yuan@fzu.edu.cn
  • Supported by:

    国家自然科学基金(批准号: 20772016), 福建省自然科学基金(批准号: 2009J05028, 2010J01036 ), 福建省科技计划重点项目(批准号: 2009H0021), 福建省教育厅科研资助项目(批准号: JA07017)和福州大学光催化省部共建国家重点实验室培育基地开放课题(批准号: K-081009)资助.

Abstract: Two Novel 3-diferrocenyl dihydropyrazole derivatives were synthesized from corresponding α,β-unsaturated ketones. The structures of these compounds were characterized by IR, 1H NMR spectra and X-ray single crystal diffraction. The crystal structure of compound 3a belongs to the orthorhombic,space group P2(1)2(1)2(1) with the lattice parameters a = 0.59466(12) nm,b = 1.9402(8) nm,c = 3.1274(6) nm,α = 90.00°,β = 90.00°,γ = 90.00°,Z = 4,F(000) = 1280,DC = 1.442 g/cm3,μ = 0.817 nm-1. Its crystal structure showed that chain-like one-dimentional structure was formed along a axis by the intermolecular hydrogen bonds.The compound 3b belongs to the monoclinic, space group P2(1)/c,and its lattice parameters are as follows: a = 1.3087(3) nm,b = 0.9844(2) nm,c = 1.7752(4) nm,α = 90.00°,β = 99.42(3)°,γ = 90.00°,Z = 4,F(000) = 1112.0,DC = 1.617 g/cm3,μ = 2.558 nm-1. The intermolecular hydrogen bonds between the sulfonyl oxygen and nonsubstituted cyclopentadienyl (Cp) hydrogen and bromobenzene hydrogen led to the formation of stable supermolecular structure of one 3b with three otherwise 3b molecules.

Key words: Ferrocenyl derivatives, Dihydropyrazole, Intermolecular hydrogen bond, Molecular assembly

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