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. 2022 Feb 1;7(Pt 2):x220077. doi: 10.1107/S2414314622000773

Table 2. Experimental details.

Crystal data
Chemical formula K2[Ag2(C16H16N2O8S4)]5.2H2O
M r 880.17
Crystal system, space group Monoclinic, P21/c
Temperature (K) 153
a, b, c (Å) 13.386 (3), 6.0085 (7), 17.843 (3)
β (°) 108.657 (15)
V3) 1359.7 (4)
Z 2
Radiation type Mo Kα
μ (mm−1) 2.12
Crystal size (mm) 0.24 × 0.13 × 0.05
 
Data collection
Diffractometer Stoe IPDS 2
Absorption correction Multi-scan (MULABS; Spek, 2020)
T min, T max 0.611, 1.000
No. of measured, independent and observed [I > 2σ(I)] reflections 9305, 2316, 2088
R int 0.043
(sin θ/λ)max−1) 0.591
 
Refinement
R[F 2 > 2σ(F 2)], wR(F 2), S 0.048, 0.114, 1.17
No. of reflections 2316
No. of parameters 218
H-atom treatment H-atom parameters constrained
Δρmax, Δρmin (e Å−3) 1.14, −1.10

Computer programs: X-AREA (Stoe & Cie, 2002), X-RED32 (Stoe & Cie, 2002), SHELXS97 (Sheldrick, 2008), PLATON (Spek, 2020) and Mercury (Macrae et al., 2020), SHELXL2018/3 (Sheldrick, 2015), PLATON (Spek, 2020) and publCIF (Westrip, 2010).