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. 2018 Sep 28;74(Pt 10):1513–1516. doi: 10.1107/S2056989018013117

Table 2. Experimental details.

Crystal data
Chemical formula C23H23NO
M r 329.42
Crystal system, space group Monoclinic, P21/c
Temperature (K) 296
a, b, c (Å) 12.6628 (4), 20.3304 (9), 7.3838 (3)
β (°) 104.895 (3)
V3) 1837.01 (13)
Z 4
Radiation type Mo Kα
μ (mm−1) 0.07
Crystal size (mm) 0.61 × 0.47 × 0.25
 
Data collection
Diffractometer Stoe IPDS 2
Absorption correction Integration
T min, T max 0.963, 0.982
No. of measured, independent and observed [I > 2σ(I)] reflections 22781, 3419, 2128
R int 0.106
(sin θ/λ)max−1) 0.606
 
Refinement
R[F 2 > 2σ(F 2)], wR(F 2), S 0.081, 0.255, 1.04
No. of reflections 3419
No. of parameters 226
No. of restraints 19
H-atom treatment H-atom parameters constrained
Δρmax, Δρmin (e Å−3) 0.44, −0.50

Computer programs: X-AREA and X-RED32 (Stoe & Cie, 2002), SHELXL2017/1 (Sheldrick, 2015), ORTEP-3 for Windows and WinGX (Farrugia, 2012) and PLATON (Spek, 2009).