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Crystal Structures of N, N'-Bis (4-chlorophenyl)-1, 10-diaza-18-crown-6 and Its Complex with Ba (SCN)_2

Crystal Structures of N,N′—Bis(4—chlorophenyl)—1,10—diaza—18—crown—6
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摘要 The title compounds,C_(24)H_(32)Cl_2,N_2O_4(I)and C_(26)H_(32)BaCl_2N_4O_4S_2 (Ⅱ)have been synthesized and crystal structures determined. The crystallographic data are as follows: (I)M_r=483. 44,orthorhombic, space group P2_12_12_1,a= 4. 852 (1), b= 11. 989(2), c=41. 231 (8) A, V=2398. 7(8) A ̄3, Z=4, μ(MoKa)=3. 07 cm ̄(-1), D_c=1. 338 g/cm ̄3, F(000)=960, R=0. 0678, R_w=0. 0514. (Ⅱ) M_r=736.93, monoclinic, space group P2_1/c, a=8. 801 (2), b=11. 653(9) , c=15. 756(6) A,β=105. 96(3)°, V=1553. 7(14) A ̄3, Z= 2, μ(MoKa)=16. 58 cm ̄(-1), D_c=1. 575 g/ cm ̄3, F(000)= 740. In compound Ⅱ, the Ba cation is coordinated by four oxygen atoms, two mitrogen atoms of diazo-18-crown-6 and two nitrogen atoms from SCN ̄- to form a distorted D_(6h) geometry with the Ba ̄(2+) at the center of crystallographic symmetry.
出处 《Chinese Journal of Structural Chemistry》 SCIE CAS CSCD 1996年第1期15-19,共5页 结构化学(英文)
关键词 diazacrown ether complexing agent barium complex crystal structure 晶体结构 双(4-氯苯基)-1,10-二氮-18-冠(醚)-6 金属配合物 配位剂 硫氰酸钡
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