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1 /CH15728_AC The Authors 2016 Australian Journal of Chemistry 2016, 69(8), Supplementary Material Structural Diversity and Properties of Six Zn II /Cd II Coordination Polymers Based on a O Bridged Semi-rigid Bis-pyridyl-bis-amide and Different Dicarboxylates Xiu-li Wang, Xiao-Mei Wu, Guo-Cheng Liu, Nai-Li Chen, Hong-Yan Lin, Xiang Wang Department of Chemistry, Bohai University, Jinzhou , People s Republic of China Table S1. Selected bond distances (Å) and angles ( ) for complex 1 C40H42N4O13Zn2 Zn(1)-O(1) 1.928(5) Zn(1)-O(4)A 1.937(4) Zn(1)-O(8) 1.946(5) Zn(1)-N(4)B 2.010(5) Zn(2)A-O(3)A 1.894(5) Zn(2)A-O(7)A 1.948(5) Zn(2)A-O(5)A 1.962(5) Zn(2)A-O(6)A 2.438(5) Zn(2)A-N(1)A 2.052(5) O(1)-Zn(1)-O(8) 100.7(2) O(1)-Zn(1)-O(4)A 111.4(2) O(1)-Zn(1)-N(4)B 128.1(2) O(4)A-Zn(1)-O(8) 121.1(2) O(8)-Zn(1)-N(4)B 95.7(2) O(4)A-Zn(1)-N(4)B 100.7(2) O(3)A-Zn(2)A-O(5)A 134.0(2) O(3)A-Zn(2)A-O(7)A 111.5(2) O(3)A-Zn(2)A-N(1)A 104.0(2) O(7)A-Zn(2)A-O(5)A 100.1(2) O(5)A-Zn(2)A-N(1)A 105.6(2) O(7)A-Zn(2)A-N(1)A 95.0(2) O(7)A-Zn(2)A-O(6)A (19) O(3)A-Zn(2)A-O(6)A 89.44(19) N(1)A-Zn(2)A-O(6)A 88.3(2) O(5)A-Zn(2)A-O(6)A 57.44(17) * Corresponding author. Tel: , Fax: address: wangxiuli@bhu.edu.cn (X.L. Wang). 1
2 Selected bond distances (Å) and angles ( ) for complex 2 C33H30N4O10Zn Zn(1)-O(3)A 1.992(4) Zn(1)-O(1) 1.987(4) Zn(1)-O(2) 2.613(5) Zn(1)-O(4)A 2.612(5) Zn(1)-N(1) 2.025(4) Zn(1)-N(4)B 2.038(4) O(3)A-Zn(1)-O(1) 93.11(14) O(3)A-Zn(1)-N(1) (16) O(1)-Zn(1)-N(1) (17) O(3)A-Zn(1)-N(4)B (16) O(1)-Zn(1)-N(4)B (17) N(1)-Zn(1)-N(4)B (16) (c) Selected bond distances (Å) and angles ( ) for complex 3 C32H24N4O8Zn Zn(1)-O(1) (15) Zn(1)-O(3)A (14) Zn(1)-N(1) (18) Zn(1)-N(4)B (19) O(1)-Zn(1)-O(3)A (7) O(1)-Zn(1)-N(1) (7) O(3)A-Zn(1)-N(1) 98.05(7) O(1)-Zn(1)-N(4)B (7) O(3)A-Zn(1)-N(4)B 95.45(7) N(1)-Zn(1)-N(4)B (7) (d) Selected bond distances (Å) and angles ( ) for complex 4 C40H42N4O13Cd2 Cd(1)-O(1) 2.229(6) Cd(1)-O(7)A 2.242(6) Cd(1)-O(5) 2.303(6) Cd(1)-N(1) 2.340(7) Cd(1)-O(4) 2.389(6) Cd(1)-O(6) 2.497(6) Cd(2)-O(8)A 1.999(7) Cd(2)-O(2) 2.033(6) Cd(2)-N(4)B 2.099(7 Cd(2)-O(3) 2.112(6) Cd(2)-O(4) 2.483(8) O(1)-Cd(1)-O(7)A 114.2(3) O(1)-Cd(1)-O(5) 151.2(2) O(7)A-Cd(1)-O(5) 94.1(2) O(1)-Cd(1)-N(1) 93.6(2) O(7)A-Cd(1)-N(1) 87.3(2) O(5)-Cd(1)-N(1) 93.0(2) O(1)-Cd(1)-O(4) 89.1(2) O(7)A-Cd(1)-O(4) 89.3(2) O(5)-Cd(1)-O(4) 85.8(2) N(1)-Cd(1)-O(4) 176.3(2) O(1)-Cd(1)-O(6) 96.9(2) O(7)A-Cd(1)-O(6) 148.9(2) O(5)-Cd(1)-O(6) 54.9(2) N(1)-Cd(1)-O(6) 91.0(3) O(4)-Cd(1)-O(6) 91.3(3) O(8)A-Cd(2)-O(2) 118.6(3) O(8)A-Cd(2)-N(4)B 98.3(3) O(2)-Cd(2)-N(4)B 100.8(3) O(8)A-Cd(2)-O(3) 127.5(3) O(2)-Cd(2)-O(3) 107.6(3) N(4)B-Cd(2)-O(3) 96.2(3) O(8)A-Cd(2)-O(4) 94.2(3) O(2)-Cd(2)-O(4) 95.8(2) N(4)B-Cd(2)-O(4) 151.1(2) O(3)-Cd(2)-O(4) 55.9(2) 2
3 (e) Selected bond distances (Å) and angles ( ) for complex 5 C33H28N4O9Cd Cd(1)-O(1) 2.253(2) Cd(1)-O(3)A 2.282(2) Cd(1)-O(7)B 2.496(2) Cd(1)-O(2) 2.549(2) Cd(1)-N(4)C 2.338(3) Cd(1)-N(1) 2.352(3) O(1)-Cd(1)-O(3)A 88.61(8) O(1)-Cd(1)-N(4)C (9) O(3)ACd(1)-N(4)C (8) O(1)-Cd(1)-N(1) 96.13(9) O(3)A-Cd(1)-N(1) 92.63(8) N(4)C-Cd(1)-N( (9) O(1)-Cd(1)-O(7)B 87.63(9) O(3)A-Cd(1)-O(7)B 82.73(8) N(4)C-Cd(1)-O(7)B 81.46(8) N(1)-Cd(1)-O(7)B (8) O(1)-Cd(1)-O(2) 53.77(8) O(3)A-Cd(1)-O(2) (8) N(4)C-Cd(1)-O(2) 83.82(8) N(1)-Cd(1)-O(2) 93.55(9) O(7)B-Cd(1)-O(2) 92.47(8) (f) Selected bond distances (Å) and angles ( ) for complex 6 C32H26N4O9Cd Cd(1)-O(1) (18) Cd(1)-N(4) 2.311(2) Cd(1)-O(3)A (19) Cd(1)-N(1) 2.352(2) Cd(1)-O(9) (19) Cd(1)-O(4)A (19) O(1)-Cd(1)-N(4) (7) O(1)-Cd(1)-O(3)A 92.36(7) N(4)-Cd(1)-O(3)A (7) O(1)-Cd(1)-N(1) 95.50(8) N(4)-Cd(1)-N(1) 92.07(7) O(3)A-Cd(1)-N(1) (7) O(1)-Cd(1)-O(9) 87.35(7) N(4)-Cd(1)-O(9) 82.69(7) O(3)A-Cd(1)-O(9) 81.46(7) N(1)-Cd(1)-O(9) (7) O(1)-Cd(1)-O(4)A (7) N(4)-Cd(1)-O(4)A 84.10(7) O(3)A-Cd(1)-O(4)A 53.59(7) N(1)-Cd(1)-O(4)A 85.26(7) O(9)-Cd(1)-O(4)A 95.00(7) 3
4 (c) (d) Fig.S1 The coordination environment of Zn II ion in complex 3. The hydrogen atoms and the crystalline water molecules are omitted for clarity (A: 1 + x, y, z; B: 2 + x, y, 1 + z); View of the 1D [Zn(bdc)]n linear chain and the 1D [Zn(L)]n 4
5 left-handed helix chain; (c) 2D layer of complex 3; (d) Simplification of the 4-connected network. Fig.S2 View of the 1D [Zn(L)]n left-handed helix chain and [Zn(mip)]n linear chain in 2. 5
6 (c) Fig.S3 The coordination environment of Cd II ion in complex 4. The hydrogen atoms and the crystalline water molecules are omitted for clarity (A: x, y, z; B: x, 1 + y, 1 + z); 2D layer of complex 4. (c) Simplification of the structure to a 3,4-connected network. Fig.S4 View of the 1D [Cd(mip)]n linear chain in 5. (c) 6
7 (d) Fig.S5 Coordination environment of Cd II ion in 6. The hydrogen atoms and the crystalline water molecules are omitted for clarity (A: 1 + x, y, z;); The 1D channel-like chain of 6; (c) 2D layer of complex 6; (d) Simplification of the 3,5-connected network. 7
8 (c) (d) (e) 8
9 (f) Fig.S6 IR spectra for complexes
10 (c) (d) (e) Fig. S7 The simulated (black) and experimental (red) and after photocatalytic 10
11 processes (blue and dark cyan) PXRD patterns for complexes 1 6 (except 4 due to its low yield). Fig. S8 TG curves for complexes 1 6 (except 4 due to its low yield). 11
12 (c) (d) Fig. S9 Absorption spectra of the MB solution during the decomposition reaction 12
13 under UV light irradiation with the use of complexes 1, 2, 5, and 6. (c) 13
14 (d) Fig. S10 Absorption spectra of the RhB solution during the decomposition reaction under UV light irradiation with the use of complexes 1, 2, 5, and 6. 14
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