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首页> 外文期刊>Polyhedron: The International Journal for Inorganic and Organometallic Chemistry >The new type of [Zr-6(mu(3)-O)(4)(mu(3)-OH)(4)] cluster core: Crystal structure and spectral characterization of [Zr6O4(OH)(4)(OOCR)(12)] (R = Bu-t, C(CH3)(2)Et)
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The new type of [Zr-6(mu(3)-O)(4)(mu(3)-OH)(4)] cluster core: Crystal structure and spectral characterization of [Zr6O4(OH)(4)(OOCR)(12)] (R = Bu-t, C(CH3)(2)Et)

机译:新型[Zr-6(mu(3)-O)(4)(mu(3)-OH)(4)团簇核:[Zr6O4(OH)(4)(OOCR)的晶体结构和光谱表征)(12)](R = Bu-t,C(CH3)(2)Et)

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摘要

Hexanuclear Zr(IV) oxo carboxylate derivatives of the general formula [Zr6O4(OH)(4)(OOCR')(12)] (R' = Bu' (1), C(CH3)(2)Et (2)) were synthesized from Zr(OR)(4) (R = Pr', C(CH3)(2)Et) and appropriate organic acids (HOOCR', R'= Bu, C(CH3)(2)Et) in a molar ratio 1:2. The crystal structures of 1 and 2 were solved in the centrosymmetric R3 space group. Zirconium atoms form hexanuclear Zr(IV) clusters, linked by 4:4 system of mu(3)-oxo/hydoxo bridges and stabilized by syn-syn carboxylate groups. Each of the metal ions is surrounded by eight oxygen atoms derived from four mu(3)-O; OXO/hydroxo bridges, and four mu-O; carboxylate ones. Analysis of crystallographic and spectroscopic data suggests that four protons migrate between eight oxide bridges of the [Zr6O4(OH)(4)(OOCR')(12)] cluster. Thermogravimetric and temperature variable (VT IR) studies have been carried out in order to determine the thermal behaviors of 1 and 2. (c) 2006 Elsevier Ltd. All rights reserved.
机译:通式[Zr6O4(OH)(4)(OOCR')(12)]的六核Zr(IV)羰基羧酸酯衍生物(R'= Bu'(1),C(CH3)(2)Et(2))由Zr(OR)(4)(R = Pr',C(CH3)(2)Et)和合适的有机酸(HOOCR',R'= Bu,C(CH3)(2)Et)合成比例1:2。 1和2的晶体结构解析为中心对称的R3空间群。锆原子形成六核Zr(IV)簇,由mu(3)-oxo / hydoxo桥的4:4系统连接,并由syn-syn羧酸盐基团稳定。每个金属离子被八个mu(3)-O衍生的八个氧原子包围; OXO /羟基桥和四个mu-O;羧酸盐。晶体学和光谱数据分析表明,四个质子在[Zr6O4(OH)(4)(OOCR')(12)]簇的八个氧化桥之间迁移。为了确定1和2的热行为,已经进行了热重和温度变量(VT IR)研究。(c)2006 Elsevier Ltd.保留所有权利。

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