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Synthesis and Crystal Structure of an Ionic Compound [Fe(CN)_6·(PhCH_2NC_9H_7)_4]·12H_2O

Synthesis and Crystal Structure of an Ionic Compound [Fe(CN)_6·(PhCH_2NC_9H_7)_4]·12H_2O
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摘要 A novel ionic compound [Fe(CN)6·(PhCHeNC9H7)4]·12H2O(C70H80FeN10O12, Mr = 1309.29) has been synthesized and its structure was characterized by I-R, elemental analysis and X-ray diffraction. The compound crystaUizes in triclinic, space group P1, with a = 10.968(7), b = 11.466(7), c = 14.077(8)A, α= 87.014(7), β= 78.124(7), γ = 72.708(7)°, V = 1654.1(17)A3, Z = 1, Dc = 1.314 g·cm^-3, F(000) = 692, p = 0.298 mm^-1, the final R = 0.0519 and wR = 0.1355. The building unit of the title compound consists of four (PhCH2N+C9H7) ions, one [Fe(CN)6]4- anion, and a dozen water molecules. According to the structural analysis, [Fe(CN)6]4- ions are linked together by O-H…O and O-H…N hydrogen bonds, while (PhCH2N+C9HT) and [Fe(CN)6]4- ions interact with each other by electrostatic force to form an ionic compound. A novel ionic compound [Fe(CN)6·(PhCHeNC9H7)4]·12H2O(C70H80FeN10O12, Mr = 1309.29) has been synthesized and its structure was characterized by I-R, elemental analysis and X-ray diffraction. The compound crystaUizes in triclinic, space group P1, with a = 10.968(7), b = 11.466(7), c = 14.077(8)A, α= 87.014(7), β= 78.124(7), γ = 72.708(7)°, V = 1654.1(17)A3, Z = 1, Dc = 1.314 g·cm^-3, F(000) = 692, p = 0.298 mm^-1, the final R = 0.0519 and wR = 0.1355. The building unit of the title compound consists of four (PhCH2N+C9H7) ions, one [Fe(CN)6]4- anion, and a dozen water molecules. According to the structural analysis, [Fe(CN)6]4- ions are linked together by O-H…O and O-H…N hydrogen bonds, while (PhCH2N+C9HT) and [Fe(CN)6]4- ions interact with each other by electrostatic force to form an ionic compound.
出处 《Chinese Journal of Structural Chemistry》 SCIE CAS CSCD 2009年第7期859-863,共5页 结构化学(英文)
基金 supported by the Natural Science Foundation of Education Committee of Henan Province (2006150016)
关键词 N-benzyl-benzopyridine ferrocyanic anion SUPRAMOLECULAR ionic compound N-benzyl-benzopyridine, ferrocyanic anion, supramolecular, ionic compound
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