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Table 2 Crystallographic data and structural correction conditions of 3-nitro-p-chloromethylbenzoic acid

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

Empirical formula C7H5ClN2O4
Fomular weight 216.58
Crystalsystem Monoclinic
Space group P2(1)/c
Wavelength(Å) 0.71073
Temperature(K) 293(2)
a (Å) 7.5316(7)
b (Å) 17.0508(15)
c (Å) 14.1080(13)
α(°) 90.00
β(°) 100.6050(10)
γ(°) 90.00
V (Å3) 1780.8(3)
Z 8
Density (g/cm3) 1.515
μ(mm−1) 0.418
F(000) 880
θ range (°) 2.389 to 23.956
GOF on F2 1.036
R1, wR2 [I > 2σ(I)] R1 = 0.0661
wR2 = 0.1719
R1, wR2 (all data) R1 = 0.1127
wR2 = 0.2159