由2-甲基咪唑-4,5-二羧酸构筑的双核平行六面体三维钙配位聚合物

引用本文: 聂旭亮, 熊辉, 涂勇刚, 黄长干. 由2-甲基咪唑-4,5-二羧酸构筑的双核平行六面体三维钙配位聚合物[J]. 无机化学学报, 2013, 29(9): 1962-1968. doi: 10.3969/j.issn.1001-4861.2013.00.208 shu

Citation: NIE Xu-Liang, Xiong Hui, TU Yong-Gang, HUANG Chang-Gan. Binuclear Parallelepiped Three-Dimensional Ca(Ⅱ) Coordination Polymer Constructed by 2-Methylimidazole-4,5-dicarboxylate Ligand[J]. Chinese Journal of Inorganic Chemistry, 2013, 29(9): 1962-1968. doi: 10.3969/j.issn.1001-4861.2013.00.208 shu

由2-甲基咪唑-4,5-二羧酸构筑的双核平行六面体三维钙配位聚合物

基金项目:
国家自然科学基金(No.30760021) (No.30760021)

江西省自然科学基金(No.0530016) (No.0530016)

江西省教育厅青年基金(No.GJ10421,No.GJ13261)资助项目。 (No.GJ10421,No.GJ13261)

摘要: 合成了一个双核钙配合物{[Ca₂(μ₃-HMIA^2-)(μ₅-HMIA^2-)(H₂O)]·H₂O}_n(1,H₃MIA=2-甲基咪唑-4,5-二羧酸),并用元素分析、红外光谱和X-射线单晶衍射等对其进行了表征。结构分析表明,1属单斜晶系,P2₁/c空间群,晶胞参数为a=0.860 67(11) nm,b=1.656 5(2) nm,c=1.269 24(16) nm,β=108.005 0(10)°,V=1.720 9(4) nm³,C₁₂H₁₀Ca₂N₄O₁₀,M_r=450.40,Z=4,D_c=1.728 g·cm^-3,F(000)=920,μ=0.727 mm^-1,S=1.041,λ(Mo Kα)=0.071 073 nm,R=0.026 0 and wR=0.063 8。在1晶体结构中,每个钙(Ⅱ)离子都是7配位的,但展现2个不同的配位环境。4个μ₃-HMIA^2-配体,2个μ₅-HMIA^2-配体和8个钙(Ⅱ)离子形成一个平行六面体结构[Ca₈(μ₃-HMIA)4 (μ₅-HMIA)₂]⁴⁺。μ₅-HMIA^2-配体采用独特的配位模式并连接周围的平行六面体结构形成一维链结构,配体μ₃-HMIA^2-连接相邻的一维链形成一种新的蜂窝型的二维层状结构,相邻的二维层通过μ₃-HMIA^2-配体的2个氧原子进一步形成一个三维结构。还研究了配合物1的热重分析和抑菌活性。CCDC: 869134。

关键词:

配位模式;钙(Ⅱ);2-甲基咪唑-4,5-二羧酸;水热合成;晶体结构

English

Binuclear Parallelepiped Three-Dimensional Ca(Ⅱ) Coordination Polymer Constructed by 2-Methylimidazole-4,5-dicarboxylate Ligand

1.
1 College of Science, Jiangxi Agricultural University, Nanchang 330045, China;
Received Date: 08 October 2012
Fund Project:
国家自然科学基金(No.30760021)

江西省自然科学基金(No.0530016)

江西省教育厅青年基金(No.GJ10421,No.GJ13261)资助项目。

Abstract: The title complex {[Ca₂(μ₃-HMIA^2-)(μ₅-HMIA^2-)(H₂O)]·H₂O}_n (1, H₃MIA=2-methyl-1H-imidazole-4,5-dicarboxylic acid) was synthesized by hydrothermal synthesis and characterized by elemental analysis, infrared spectroscopy, and single-crystal X-ray diffraction. Compound 1 crystallizes in monoclinic system, space group P2₁/c with a=0.860 67(11) nm, b=1.656 5(2) nm, c=1.269 24(16) nm, β=108.005 0(10)°, V=1.720 9(4) nm³, C₁₂H₁₀Ca₂N₄O₁₀, M_r=450.40, Z=4, D_c=1.728 g·cm^-3, F(000)=920, μ=0.727 mm^-1, S=1.041, λ(Mo Kα)=0.071 073 nm, R=0.026 0 and wR=0.063 8 for 3 211 observed reflections (I>2σ(I)). Compound 1 is a unique binuclear Ca(Ⅱ) parallelepiped MOFs, two Ca(Ⅱ) cations are seven-coordinated, but show different coordination environments. Four μ₃-HMIA^2-, two μ₅-HMIA^2- and eight Ca(Ⅱ) ions form a molecular parallelepiped of[Ca₈(μ₃-HMIA)4(μ₅-HMIA)₂]⁴⁺. The μ₅-HMIA^2- ligand adopts a unique coordination mode and links the neighboring parallelepipeds to form one-dimensional chain. The μ₃-HMIA^2- ligand links the neighboring one-dimensional chains to yield a two-dimensional honey comb-like network layer architectures, which are further linked through two carboxlate oxygen atoms from μ₃-HMIA^2- ligand to generate a three-dimensional MOFs. Thermal gravimetric analysis and antibacterial activities of complex 1 were also studied. CCDC: 869134.

Key words:

coordination modes;Ca(Ⅱ);2-methyl-1H-imidazole-4,5-dicarboxylic acid;hydrothermal synthesis;crystal structure

1. [1] Net G, Bayon J C, Butler W M, et al. Chem. Soc. Chem. Commun., 1989,15:1022-1023[1] Net G, Bayon J C, Butler W M, et al. Chem. Soc. Chem. Commun., 1989,15:1022-1023
2. [2] Liang Y C, Cao R, Hong M C. Inorg. Chem. Commun., 2002, 5:366-368[2] Liang Y C, Cao R, Hong M C. Inorg. Chem. Commun., 2002, 5:366-368
3. [3] Bai Y L, Tao J, Huang R B, et al. Acta Cryst., 2005,C61: m98-100[3] Bai Y L, Tao J, Huang R B, et al. Acta Cryst., 2005,C61: m98-100
4. [4] Lu W G, Jiang L, Feng X L, et al. Cryst. Growth Des., 2006, 6:564-571[4] Lu W G, Jiang L, Feng X L, et al. Cryst. Growth Des., 2006, 6:564-571
5. [5] ZHANG Xian-Fa(张现发), GAO Shan(高山), HUO Li-Hua (霍丽华), et al. Chinese J. Inorg. Chem.(Wuji Huaxue Xuebao), 2006,22(1):139-141[5] ZHANG Xian-Fa(张现发), GAO Shan(高山), HUO Li-Hua (霍丽华), et al. Chinese J. Inorg. Chem.(Wuji Huaxue Xuebao), 2006,22(1):139-141
6. [6] Yue Y F, Gao E Q, Fang C J, et al. Cryst. Growth Des., 2008,8(9):3295-3301[6] Yue Y F, Gao E Q, Fang C J, et al. Cryst. Growth Des., 2008,8(9):3295-3301
7. [7] Zhang F W, Li Z F, Ge T Z, et al. Inorg. Chem., 2010,49: 3776-3788[7] Zhang F W, Li Z F, Ge T Z, et al. Inorg. Chem., 2010,49: 3776-3788
8. [8] Feng X, Zhao J S, Liu B. et al. Cryst. Growth Des., 2010, 10:1399-1408[8] Feng X, Zhao J S, Liu B. et al. Cryst. Growth Des., 2010, 10:1399-1408
9. [9] LI Shi-Jie(李世杰), SONG Wen-Dong(宋文东), MIAO Dong-Liang(苗东亮), et al. Chinese J. Inorg. Chem.(Wuji Huaxue Xuebao), 2011,27(10):2088-2094[9] LI Shi-Jie(李世杰), SONG Wen-Dong(宋文东), MIAO Dong-Liang(苗东亮), et al. Chinese J. Inorg. Chem.(Wuji Huaxue Xuebao), 2011,27(10):2088-2094
10. [10] LIU Hong-Wen(刘宏文), RU Wen-Guan(卢文贯). Chinese J. Inorg. Chem.(Wuji Huaxue Xuebao), 2011,27(9):1810-1816[10] LIU Hong-Wen(刘宏文), RU Wen-Guan(卢文贯). Chinese J. Inorg. Chem.(Wuji Huaxue Xuebao), 2011,27(9):1810-1816
11. [11] YUAN Li(袁立), RU Wen-Guan(卢文贯). Chin. J. Inorg. Chem.(Wuji Huaxue Xuebao), 2011,27(7):1324-1328[11] YUAN Li(袁立), RU Wen-Guan(卢文贯). Chin. J. Inorg. Chem.(Wuji Huaxue Xuebao), 2011,27(7):1324-1328
12. [12] Zou R Q, Sakurai H, Xu Q. Angew. Chem. Int. Ed., 2006, 45:2542-2546[12] Zou R Q, Sakurai H, Xu Q. Angew. Chem. Int. Ed., 2006, 45:2542-2546
13. [13] Sun Y Q, Yang G Y. Dalton Trans., 2007:3771-3781[13] Sun Y Q, Yang G Y. Dalton Trans., 2007:3771-3781
14. [14] Lu W G, Gu J Z, Jiang L, et al. Cryst. Growth Des., 2008, 8:986-994[14] Lu W G, Gu J Z, Jiang L, et al. Cryst. Growth Des., 2008, 8:986-994
15. [15] Fang R Q, Zhang X M. Inorg. Chem., 2006,45:4801-4810[15] Fang R Q, Zhang X M. Inorg. Chem., 2006,45:4801-4810
16. [16] Wang S, Zhang L R, Li G H, et al. Cryst. Eng. Comm., 2008,10:1662-1666[16] Wang S, Zhang L R, Li G H, et al. Cryst. Eng. Comm., 2008,10:1662-1666
17. [17] Liu H, Qin H, Zhong X M, et al. Chin. J. Struct. Chem., 2011,30(7):1030-1036[17] Liu H, Qin H, Zhong X M, et al. Chin. J. Struct. Chem., 2011,30(7):1030-1036
18. [18] Song J F, Zhou R S, Hu T P, et al. J. Coord. Chem., 2010, 63:4201-4214[18] Song J F, Zhou R S, Hu T P, et al. J. Coord. Chem., 2010, 63:4201-4214
19. [19] Liu C B, Nie X L, Wen H L. Acta Cryst., 2007,E63:m2244-2246[19] Liu C B, Nie X L, Wen H L. Acta Cryst., 2007,E63:m2244-2246
20. [20] Nie X L, Wen H L, Wu Z S, et al. Acta Cryst., 2007,E63: m753-755[20] Nie X L, Wen H L, Wu Z S, et al. Acta Cryst., 2007,E63: m753-755
21. [21] Wen H L, Lai B W, Wu X Q, et al. Kristallogr. NCS., 2009, 224:455-456[21] Wen H L, Lai B W, Wu X Q, et al. Kristallogr. NCS., 2009, 224:455-456
22. [22] Tu Y G, Xiong Z Q, Song X Y, et al. Chin. J. Struct. Chem., 2011,30(12):1770-1774[22] Tu Y G, Xiong Z Q, Song X Y, et al. Chin. J. Struct. Chem., 2011,30(12):1770-1774
23. [23] Nie X L, Xiong Z Q, Tu Y G. Kristallogr. NCS., 2012,227: 335-336[23] Nie X L, Xiong Z Q, Tu Y G. Kristallogr. NCS., 2012,227: 335-336
24. [24] Phillips M. A. J. Chem. Soc., 1928:2393-2399[24] Phillips M. A. J. Chem. Soc., 1928:2393-2399
25. [25] Guo Y P. Acta Cryst., 2009,E65:o22[DOI: 10.1107/S1600536808040221][25] Guo Y P. Acta Cryst., 2009,E65:o22[DOI: 10.1107/S1600536808040221]
26. [26] Bruker. APEX2, SAINT and SADABS. Bruker AXS Inc, Madison, Wisconsin, USA 2005.[26] Bruker. APEX2, SAINT and SADABS. Bruker AXS Inc, Madison, Wisconsin, USA 2005.
27. [27] Sheldrick G M. SHELXS 97, Program for Crystal Structure Solution, University of Göttingen, Germany, 1997.[27] Sheldrick G M. SHELXS 97, Program for Crystal Structure Solution, University of Göttingen, Germany, 1997.
28. [28] Sheldrick G M. SHELXL-97, Program for X-ray Crystal Structure Refinement, University of Göttingen, Germany, 1997.[28] Sheldrick G M. SHELXL-97, Program for X-ray Crystal Structure Refinement, University of Göttingen, Germany, 1997.
29. [29] Zhang L Y, Zhang J P, Lin Y Y, et al. Cryst. Growth Des., 2006,6:1684-1689[29] Zhang L Y, Zhang J P, Lin Y Y, et al. Cryst. Growth Des., 2006,6:1684-1689
30. [30] Liu G X, Huang Y Q, Chu Q, et al. Cryst. Growth Des., 2008,8:3233-3245[30] Liu G X, Huang Y Q, Chu Q, et al. Cryst. Growth Des., 2008,8:3233-3245
31. [31] Basak S, Sen S, Marschner C, et al. Polyhedron., 2008,27 (4):1193-1200[31] Basak S, Sen S, Marschner C, et al. Polyhedron., 2008,27 (4):1193-1200
32. [32] WANG Juan(王娟), SU Jin-Xiong(苏进雄), TANG Xia(唐霞), et al. Chinese J. Inorg. Chem.(Wuji Huaxue Xuebao), 2011,27(5):957-962[32] WANG Juan(王娟), SU Jin-Xiong(苏进雄), TANG Xia(唐霞), et al. Chinese J. Inorg. Chem.(Wuji Huaxue Xuebao), 2011,27(5):957-962

扫一扫看文章

计量

PDF下载量: 0
文章访问数: 790
HTML全文浏览量: 145

通讯作者: 陈斌, bchen63@163.com

1.
沈阳化工大学材料科学与工程学院沈阳 110142

由2-甲基咪唑-4,5-二羧酸构筑的双核平行六面体三维钙配位聚合物

English

Binuclear Parallelepiped Three-Dimensional Ca(Ⅱ) Coordination Polymer Constructed by 2-Methylimidazole-4,5-dicarboxylate Ligand

CCS Chemistry：嵌段共聚物自组装成 “三明治”二维有机材料，实现纳米级压力传感功能

CCS Chemistry：颜徐州、鲍哲南：你的皮肤可能是一片SPMs

CCS Chemistry：工作高效不疲劳，只须让催化剂动起来

CCS Chemistry：静电组装导向聚合- 聚电解质纳米凝胶量化制备新策略

CCS Chemistry：金黄色葡萄球菌醛基脱氢酶是如何识别特异性底物的？

计量

通讯作者: 陈斌, bchen63@163.com

中国化学会秘书处

由2-甲基咪唑-4,5-二羧酸构筑的双核平行六面体三维钙配位聚合物

English

Binuclear Parallelepiped Three-Dimensional Ca(Ⅱ) Coordination Polymer Constructed by 2-Methylimidazole-4,5-dicarboxylate Ligand

CCS Chemistry：嵌段共聚物自组装成 “三明治”二维有机材料，实现纳米级压力传感功能

CCS Chemistry：颜徐州、鲍哲南： 你的皮肤可能是一片SPMs

CCS Chemistry：工作高效不疲劳，只须让催化剂动起来

CCS Chemistry：静电组装导向聚合- 聚电解质纳米凝胶量化制备新策略

CCS Chemistry：金黄色葡萄球菌醛基脱氢酶是如何识别特异性底物的？

计量

文章相关

通讯作者: 陈斌, bchen63@163.com

中国化学会秘书处

CCS Chemistry：颜徐州、鲍哲南：你的皮肤可能是一片SPMs