Skip to main content
. 2015 Sep 26;71(Pt 10):1255–1258. doi: 10.1107/S205698901501779X

Table 2. Experimental details.

Crystal data
Chemical formula SrNi2Fe(PO4)3
M r 545.80
Crystal system, space group Orthorhombic, I m m a
Temperature (K) 296
a, b, c () 10.3881(11), 13.1593(13), 6.5117(7)
V (3) 890.15(16)
Z 4
Radiation type Mo K
(mm1) 12.34
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 8211, 1112, 1095
R int 0.024
(sin /)max (1) 0.820
 
Refinement
R[F 2 > 2(F 2)], wR(F 2), S 0.015, 0.041, 1.20
No. of reflections 1112
No. of parameters 54
max, min (e 3) 0.92, 0.57

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).