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. 2018 Nov 22;74(Pt 12):1838–1841. doi: 10.1107/S2056989018016419

Table 3. Experimental details.

Crystal data
Chemical formula [Pd2(C2H8N2)2(CH2O6P2)]·4H2O
M r 577.04
Crystal system, space group Orthorhombic, F d d d
Temperature (K) 294
a, b, c (Å) 11.8871 (6), 12.5405 (6), 48.052 (2)
V3) 7163.2 (6)
Z 16
Radiation type Mo Kα
μ (mm−1) 2.24
Crystal size (mm) 0.6 × 0.4 × 0.2
 
Data collection
Diffractometer Rigaku Oxford Diffraction Xcalibur, Sapphire3
Absorption correction Multi-scan (CrysAlis PRO; Rigaku OD, 2018)
T min, T max 0.418, 1.000
No. of measured, independent and observed [I > 2σ(I)] reflections 14597, 2065, 1746
R int 0.075
(sin θ/λ)max−1) 0.649
 
Refinement
R[F 2 > 2σ(F 2)], wR(F 2), S 0.063, 0.175, 1.14
No. of reflections 2065
No. of parameters 126
H-atom treatment H-atom parameters constrained
Δρmax, Δρmin (e Å−3) 1.69, −2.06

Computer programs: CrysAlis PRO (Rigaku OD, 2018), SHELXT (Sheldrick, 2015a ), SHELXL (Sheldrick, 2015b ) and OLEX2 (Dolomanov et al., 2009).