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. 2021 Feb 19;77(Pt 3):266–269. doi: 10.1107/S205698902100181X

Table 3. Experimental details.

Crystal data
Chemical formula C26H20N2O3
M r 408.44
Crystal system, space group Monoclinic, C2/c
Temperature (K) 150
a, b, c (Å) 26.8396 (6), 5.1174 (1), 17.2574 (4)
β (°) 121.764 (1)
V3) 2015.27 (8)
Z 4
Radiation type Cu Kα
μ (mm−1) 0.72
Crystal size (mm) 0.25 × 0.06 × 0.06
 
Data collection
Diffractometer Bruker D8 VENTURE PHOTON 100 CMOS
Absorption correction Multi-scan (SADABS; Krause et al., 2015)
T min, T max 0.90, 0.96
No. of measured, independent and observed [I > 2σ(I)] reflections 15449, 1880, 1767
R int 0.031
(sin θ/λ)max−1) 0.609
 
Refinement
R[F 2 > 2σ(F 2)], wR(F 2), S 0.033, 0.086, 1.05
No. of reflections 1880
No. of parameters 182
H-atom treatment All H-atom parameters refined
Δρmax, Δρmin (e Å−3) 0.19, −0.16

Computer programs: APEX3 and SAINT (Bruker, 2016), SHELXT (Sheldrick, 2015a ), SHELXL2016/6 (Sheldrick, 2015b ), DIAMOND (Brandenburg & Putz, 2012) and SHELXTL (Sheldrick, 2008).