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. 2019 Sep 27;75(Pt 10):1540–1543. doi: 10.1107/S2056989019012969

Table 2. Experimental details.

Crystal data
Chemical formula (C2H8N)2[Zn(C6H4O8P2)]
M r 423.59
Crystal system, space group Monoclinic, P21/n
Temperature (K) 220
a, b, c (Å) 8.8455 (5), 16.4492 (9), 11.2721 (6)
β (°) 97.338 (1)
V3) 1626.67 (15)
Z 4
Radiation type Mo Kα
μ (mm−1) 1.75
Crystal size (mm) 0.09 × 0.03 × 0.03
 
Data collection
Diffractometer Bruker APEXII
Absorption correction Multi-scan (SADABS; Krause et al., 2015)
T min, T max 0.706, 0.746
No. of measured, independent and observed [I > 2σ(I)] reflections 19692, 4040, 3582
R int 0.027
(sin θ/λ)max−1) 0.681
 
Refinement
R[F 2 > 2σ(F 2)], wR(F 2), S 0.022, 0.060, 1.05
No. of reflections 4040
No. of parameters 288
No. of restraints 1
H-atom treatment All H-atom parameters refined
Δρmax, Δρmin (e Å−3) 0.42, −0.31

Computer programs: APEX3 and SAINT (Bruker, 2015), SHELXT2014/2 (Sheldrick, 2015a ), SHELXL2016/6 (Sheldrick, 2015b ), XP in SHELXTL (Sheldrick, 2008a ) and CIFTAB (Sheldrick, 2008b ).