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. 2025 Oct 9;81(Pt 11):1004–1007. doi: 10.1107/S2056989025008709

Table 2. Experimental details.

Crystal data
Chemical formula C29H31NO2
M r 425.55
Crystal system, space group Monoclinic, P21/c
Temperature (K) 300
a, b, c (Å) 13.2165 (8), 5.8983 (4), 31.503 (2)
β (°) 99.174 (2)
V3) 2424.4 (3)
Z 4
Radiation type Mo Kα
μ (mm−1) 0.07
Crystal size (mm) 0.36 × 0.22 × 0.16
 
Data collection
Diffractometer Bruker APEXII CCD
Absorption correction Multi-scan (SADABS; Krause et al., 2015)
Tmin, Tmax 0.975, 0.988
No. of measured, independent and observed [I > 2σ(I)] reflections 43823, 6019, 4053
R int 0.041
(sin θ/λ)max−1) 0.667
 
Refinement
R[F2 > 2σ(F2)], wR(F2), S 0.052, 0.168, 1.03
No. of reflections 6019
No. of parameters 290
H-atom treatment H-atom parameters constrained
Δρmax, Δρmin (e Å−3) 0.18, −0.20

Computer programs: APEX3 and SAINT (Bruker, 2017), SHELXT (Sheldrick, 2015a), SHELXL (Sheldrick, 2015b), ORTEP-3 for Windows (Farrugia, 2012) and PLATON (Spek, 2020).