Citation: ZHANG Shao-Feng, LIN Jian-Gen, LIU Jie, XIE Shi-Bo, LIU Ji-Bo, LI Hao-Hong, CHEN Zhi-Rong. A New Bismuth(Ⅲ) Iodide Inorganic/organic Hybrid Solid Containing Large Heterocyclic Conjugated Organic Ligand: Synthesis, Properties and Calculations[J]. Chinese Journal of Structural Chemistry, ;2014, 33(4): 549-556. shu

A New Bismuth(Ⅲ) Iodide Inorganic/organic Hybrid Solid Containing Large Heterocyclic Conjugated Organic Ligand: Synthesis, Properties and Calculations

1.
College of Chemistry and Chemical Engineering, Fuzhou University, Fuzhou 350108, China

Received Date: 18 September 2013
Available Online: 28 November 2013
Fund Project: Supported by the National Science Foundation for Fostering Talents in Basic Research of the National Natural Science Foundation of China (No. J1103303) (No. J1103303)National Natural Science Foundation of China (No. 21271043) (No. 21271043)

A new bismuth(Ⅲ) iodide inorganic/organic hybrid containing larger heterocyclic conjugated organic ligand, [(dppz)₂Bi₂I₆]·2DMF (1) (dppz=dipyrido[3,2-a:2',3'-c]phenazine), has been synthesized by solution process and structurally determined by X-ray diffraction method. 1 crystallizes in triclinic, space group P1 with M_r=1844.08, a=9.215(5), b=11.488(6), c=12.424(9) Å, α=106.66(2), β=90.84(2), γ=92.34(2)°, V=1258.5(13) Å³, Z=1, D_c=2.433 g/cm³, F(000)=830, μ(MoKα)=10.702 mm^-1, the final R=0.0834 and wR=0.1947 for 2749 observed reflections with I>2σ(I). 1 consists of a dimeric structure [(dppz)₂Bi₂I₆], in which two [(dppz)BiI₃] fragments are bridged by a pair of iodine atoms. Hydrogen bonds and π…π stacking interactions contribute to the structural extension and stabilization. Experimental band gap of about 2.13 eV indicates its semiconductor nature. The optical absorption spectrum and electronic structure were also discussed.
- bismuth halide,
- phenanthroline derivative,
- organic-inorganic hybrids
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