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. 2015 Oct 31;71(Pt 11):1418–1420. doi: 10.1107/S2056989015020290

Table 2. Experimental details.

Crystal data
Chemical formula [Co(NH3)6][Co(CO)4]2
M r 503.07
Crystal system, space group Trigonal, R Inline graphic
Temperature (K) 100
a, c () 9.3679(4), 18.3089(18)
V (3) 1391.48(18)
Z 3
Radiation type Mo K
(mm1) 2.70
Crystal size (mm) 0.16 0.12 0.08
 
Data collection
Diffractometer Stoe IPDS2T
Absorption correction Integration (X-RED32 and X-SHAPE; Stoe Cie, 2009)
T min, T max 0.649, 0.907
No. of measured, independent and observed [I > 2(I)] reflections 7025, 994, 910
R int 0.087
(sin /)max (1) 0.724
 
Refinement
R[F 2 > 2(F 2)], wR(F 2), S 0.034, 0.090, 1.08
No. of reflections 994
No. of parameters 52
H-atom treatment All H-atom parameters refined
max, min (e 3) 0.87, 0.65

Computer programs: X-AREA (Stoe Cie, 2011), X-RED32 (Stoe Cie, 2009), SHELXT (Sheldrick, 2015a ), SHELXLE (Hbschle et al., 2011) and SHELXL2014 (Sheldrick, 2015b ), DIAMOND (Brandenburg, 2015) and publCIF (Westrip, 2010).