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. 2016 Feb 6;72(Pt 3):293–296. doi: 10.1107/S2056989016001948

Table 2. Experimental details.

Crystal data
Chemical formula Pb2Mn(VO4)2(OH)
M r 716.21
Crystal system, space group Monoclinic, P21/m
Temperature (K) 293
a, b, c (Å) 7.6492 (1), 6.1262 (1), 8.9241 (2)
β (°) 112.195 (1)
V3) 387.20 (1)
Z 2
Radiation type Mo Kα
μ (mm−1) 47.27
Crystal size (mm) 0.05 × 0.05 × 0.05
 
Data collection
Diffractometer Bruker APEXII CCD area detector
Absorption correction Multi-scan (SADABS; Bruker, 2004)
T min, T max 0.201, 0.201
No. of measured, independent and observed [I > 2σ(I)] reflections 11674, 1521, 1356
R int 0.037
(sin θ/λ)max−1) 0.759
 
Refinement
R[F 2 > 2σ(F 2)], wR(F 2), S 0.025, 0.056, 1.05
No. of reflections 1521
No. of parameters 82
No. of restraints 1
H-atom treatment Only H-atom coordinates refined
Δρmax, Δρmin (e Å−3) 2.67, −2.16

Computer programs: APEX2 and SAINT (Bruker, 2004), SHELXL2014 (Sheldrick, 2015), XtalDraw (Downs & Hall-Wallace, 2003) and publCIF (Westrip, 2010). Coordinates taken from a previous refinement.