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. 2025 Aug 12;10(Pt 8):x250704. doi: 10.1107/S2414314625007047

Table 2. Experimental details.

Crystal data
Chemical formula C29H22F2N4O
M r 480.50
Crystal system, space group Monoclinic, P21/n
Temperature (K) 100
a, b, c (Å) 8.4575 (4), 11.5163 (5), 23.0761 (10)
β (°) 91.103 (2)
V3) 2247.17 (17)
Z 4
Radiation type Mo Kα
μ (mm−1) 0.10
Crystal size (mm) 0.22 × 0.14 × 0.13
 
Data collection
Diffractometer Bruker SMART APEXII area detector
Absorption correction Multi-scan (SADABS; Krause et al., 2015)
Tmin, Tmax 0.688, 0.746
No. of measured, independent and observed [I > 2σ(I)] reflections 15704, 5044, 3821
R int 0.030
(sin θ/λ)max−1) 0.650
 
Refinement
R[F2 > 2σ(F2)], wR(F2), S 0.042, 0.113, 1.04
No. of reflections 5044
No. of parameters 325
H-atom treatment H-atom parameters constrained
Δρmax, Δρmin (e Å−3) 0.30, −0.24

Computer programs: APEX2 and SAINT (Bruker, 2014), SHELXT (Sheldrick, 2015a), SHELXL2018/3 (Sheldrick, 2015b) and OLEX2 (Dolomanov et al., 2009).