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. 2018 Apr 19;74(Pt 5):682–686. doi: 10.1107/S2056989018005832

Table 3. Experimental details.

Crystal data
Chemical formula C34H28N2O4
M r 528.58
Crystal system, space group Orthorhombic, C m c21
Temperature (K) 293
a, b, c (Å) 35.297 (3), 9.3902 (6), 8.3603 (5)
V3) 2771.0 (3)
Z 4
Radiation type Mo Kα
μ (mm−1) 0.08
Crystal size (mm) 0.03 × 0.02 × 0.01
 
Data collection
Diffractometer Bruker APEXII CCD
No. of measured, independent and observed [I > 2σ(I)] reflections 4493, 2516, 1691
R int 0.042
(sin θ/λ)max−1) 0.651
 
Refinement
R[F 2 > 2σ(F 2)], wR(F 2), S 0.053, 0.158, 1.02
No. of reflections 2516
No. of parameters 185
No. of restraints 1
H-atom treatment H-atom parameters constrained
Δρmax, Δρmin (e Å−3) 0.29, −0.24

Computer programs: APEX2 and SAINT (Bruker, 2011), SHELXT2017 (Sheldrick, 2015a ), SHELXL2017 (Sheldrick, 2015b ), SHELXTL (Sheldrick, 2008), Mercury (Macrae et al.2008) and PLATON (Spek, 2009).