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. 2016 Apr 5;72(Pt 5):632–634. doi: 10.1107/S2056989016005417

Table 1. Experimental details.

Crystal data
Chemical formula Na4Ni7(AsO4)6
M r 1336.3
Crystal system, space group Monoclinic, C2/m
Temperature (K) 293
a, b, c (Å) 14.5383 (11), 14.5047 (11), 10.6120 (8)
β (°) 118.299 (2)
V3) 1970.3 (3)
Z 4
Radiation type Mo Kα
μ (mm−1) 16.76
Crystal size (mm) 0.07 × 0.06 × 0.04
 
Data collection
Diffractometer Bruker D8 Venture
Absorption correction Multi-scan (SADABS; Bruker, 2015)
T min, T max 0.640, 0.747
No. of measured, independent and observed [I > 3σ(I)] reflections 48075, 3773, 2901
R int 0.036
(sin θ/λ)max−1) 0.772
 
Refinement
R[F 2 > 2σ(F 2)], wR(F 2), S 0.039, 0.052, 2.73
No. of reflections 3773
No. of parameters 146
Δρmax, Δρmin (e Å−3) 3.34, −2.22

Computer programs: APEX3 and SAINT (Bruker, 2015), SUPERFLIP (Palatinus & Chapuis, 2007), JANA2006 (Petříčcek et al., 2014, DIAMOND (Brandenburg, 2006) and publCIF (Westrip, 2010).