Table 2. Experimental details.
Crystal data | |
Chemical formula | C22H31NO3 |
M r | 357.48 |
Crystal system, space group | Monoclinic, P21/c |
Temperature (K) | 150 |
a, b, c (Å) | 17.6928 (7), 13.2512 (5), 8.5916 (3) |
β (°) | 90.184 (2) |
V (Å3) | 2014.30 (13) |
Z | 4 |
Radiation type | Cu Kα |
μ (mm−1) | 0.61 |
Crystal size (mm) | 0.25 × 0.17 × 0.10 |
Data collection | |
Diffractometer | Bruker D8 VENTURE PHOTON 100 CMOS |
Absorption correction | Multi-scan (SADABS; Krause et al., 2015 ▸) |
T min, T max | 0.82, 0.94 |
No. of measured, independent and observed [I > 2σ(I)] reflections | 14697, 3924, 3044 |
R int | 0.048 |
(sin θ/λ)max (Å−1) | 0.618 |
Refinement | |
R[F 2 > 2σ(F 2)], wR(F 2), S | 0.046, 0.105, 1.07 |
No. of reflections | 3924 |
No. of parameters | 359 |
H-atom treatment | All H-atom parameters refined |
Δρmax, Δρmin (e Å−3) | 0.19, −0.18 |