Skip to main content
. 2015 May 20;71(Pt 6):647–649. doi: 10.1107/S2056989015009135

Table 2. Experimental details.

Crystal data
Chemical formula K5[H2PtV9O28]9H2O
M r 1461.21
Crystal system, space group Triclinic, P Inline graphic
Temperature (K) 298
a, b, c () 10.1663(7), 12.8350(7), 13.615(2)
, , () 103.734(5), 106.193(6), 92.480(4)
V (3) 1645.8(3)
Z 2
Radiation type Mo K
(mm1) 7.42
Crystal size (mm) 0.21 0.19 0.17
 
Data collection
Diffractometer Stoe Stadi4
Absorption correction Empirical (using intensity measurements) (X-SHAPE; Stoe Cie,1996)
T min, T max 0.301, 0.378
No. of measured, independent and observed [I > 2(I)] reflections 6797, 6797, 6242
(sin /)max (1) 0.628
 
Refinement
R[F 2 > 2(F 2)], wR(F 2), S 0.028, 0.066, 1.10
No. of reflections 6797
No. of parameters 526
No. of restraints 25
H-atom treatment H atoms treated by a mixture of independent and constrained refinement
max, min (e 3) 1.30, 1.46

Computer programs: STADI4 and X-RED (Stoe Cie, 1996), SHELXS2014 (Sheldrick, 2008), SHELXL2014 (Sheldrick, 2015), ORTEP-3 for Windows (Farrugia, 2012) and DIAMOND (Brandenburg, 1998).