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. 2020 Jul 28;5(Pt 7):x201018. doi: 10.1107/S2414314620010184

Table 2. Experimental details.

Crystal data
Chemical formula C19H24O5
M r 332.38
Crystal system, space group Monoclinic, P21/c
Temperature (K) 120
a, b, c (Å) 13.1494 (10), 9.6899 (6), 14.8185 (13)
β (°) 113.295 (6)
V3) 1734.2 (2)
Z 4
Radiation type Mo Kα
μ (mm−1) 0.09
Crystal size (mm) 0.22 × 0.11 × 0.06
 
Data collection
Diffractometer Stoe IPDS 2T
No. of measured, independent and observed [I > 2σ(I)] reflections 8583, 4123, 2784
R int 0.036
(sin θ/λ)max−1) 0.659
 
Refinement
R[F 2 > 2σ(F 2)], wR(F 2), S 0.072, 0.185, 1.05
No. of reflections 4123
No. of parameters 222
H-atom treatment H-atom parameters constrained
Δρmax, Δρmin (e Å−3) 0.24, −0.30

Computer programs: X-AREA WinXpose, X-AREA Recipe and X-AREA Integrate (Stoe & Cie, 2019), SIR2004 (Burla et al., 2005), SHELXL2018/3 (Sheldrick, 2015) and PLATON (Spek, 2020).