Skip to main content
. 2015 Apr 25;71(Pt 5):558–560. doi: 10.1107/S2056989015007926

Table 1. Experimental details.

Crystal data
Chemical formula Na2Co2Fe(PO4)3
M r 504.60
Crystal system, space group Monoclinic, C2/c
Temperature (K) 296
a, b, c () 11.7106(6), 12.4083(7), 6.4285(3)
() 113.959(2)
V (3) 853.63(8)
Z 4
Radiation type Mo K
(mm1) 6.26
Crystal size (mm) 0.31 0.25 0.19
 
Data collection
Diffractometer Bruker X8 APEX
Absorption correction Multi-scan (SADABS; Bruker, 2009)
T min, T max 0.504, 0.748
No. of measured, independent and observed [I > 2(I)] reflections 15289, 1882, 1807
R int 0.030
(sin /)max (1) 0.806
 
Refinement
R[F 2 > 2(F 2)], wR(F 2), S 0.016, 0.046, 1.10
No. of reflections 1879
No. of parameters 95
max, min (e 3) 0.70, 0.92

Computer programs: APEX2 and SAINT (Bruker, 2009), SHELXS97 and SHELXL97 (Sheldrick, 2008), ORTEP-3 for Windows (Farrugia, 2012), DIAMOND (Brandenburg, 2006) and publCIF (Westrip, 2010).