catena-poly[[diaquazinc(II)]-μ-4,4'-sulfonyldibenzoato-κ2O:O'] | 956795-88-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: catena-poly[[diaquazinc(II)]-μ-4,4'-sulfonyldibenzoato-κ2O:O']
• CAS: 956795-88-3
• 化学式: C₁₄H₁₂O₈SZn
• 分子量: 405.7
• InChiKey: INIOIFAEVGSTHR-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
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• 重原子数：
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• 可旋转键数：
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• 环数：
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• sp3杂化的碳原子比例：
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• 拓扑面积：
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• 氢给体数：
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• 氢受体数：
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反应信息

• 作为产物：
  描述：

  4,4-硫酰双(甲基苯甲酸) 、 水 、 zinc(II) acetate dihydrate 在 NaOH 作用下， 以 水 为溶剂， 生成 catena-poly[[diaquazinc(II)]-μ-4,4'-sulfonyldibenzoato-κ2O:O']
  参考文献：
  名称：

  catena-Poly[[diaquazinc(II)]-μ-4,4′-sulfonyldibenzoato-κ²O:O′]

  摘要：

  The title compound, [Zn(C14H8O6S)(H2O)(2)](n), is the first reported metal complex of the 4,4'-sulfonyldibenzoate anion. The structure comprises zigzag chains of alternating [Zn(H2O)(2)]](2+) and sulfonyldibenzoate units, the central Zn and S atoms of which lie on crystallographic twofold axes. The Zn-II centre occupies a strongly distorted tetrahedral environment [O-Zn-O = 83.30 (7)-136.19 (8)degrees], coordinated by the two water O atoms [Zn-O = 1.986 (2) angstrom] and one O atom from each of two carboxylate groups [Zn-O = 1.9942 (19) angstrom], with much longer contacts to the other O atoms of these carboxylates [Zn-O = 2.528 (2) angstrom]. Hydrogen bonds between carboxylate O atoms and coordinated water molecules in adjacent chains lead to the formation of a three-dimensional network structure.

  DOI：

  10.1107/s0108270107008244