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Table 4 Crystallographic data and structural correction conditions of Zn2(EBNB)2(BPY)2·2H2O

From: The properties of MOF-Zn2(EBNB)2(BPY)2·2H2O and its basic study of loading methadone

Empirical formula C26H18N4O9Zn
Fomular weight 595.81
Crystal system Triclinic
Space group P-1
Wavelength(Å) 0.71073
Temperature(K) 293(2)
a(Å) 8.1862(9)
b(Å) 11.4220(14)
c(Å) 14.2863(17)
α(°) 96.8030(10)
β(°) 93.0450(10)
γ(°) 102.472(2)
V(Å3) 1290.8(3)
Z 2
Density (g/cm3) 1.533
μ(mm−1) 1.013
F(000) 608
θ range (°) 2.557 to 26.079
GOF on F2 1.008
R1, wR2 [I > 2σ(I)] R1 = 0.0499
wR2 = 0.1067
R1, wR2 (all data) R1 = 0.0750
wR2 = 0.1153