| Refinement on F2 | Hydrogen site location: inferred from neighbouring sites |
| Least-squares matrix: full | H-atom parameters constrained |
| R[F2 > 2σ(F2)] = 0.038 | w = 1/[σ2(Fo2) + (0.0605P)2 + 0.0861P] where P = (Fo2 + 2Fc2)/3 |
| wR(F2) = 0.102 | (Δ/σ)max = 0.001 |
| S = 1.10 | Δρmax = 0.21 e Å−3 |
| 2010 reflections | Δρmin = −0.20 e Å−3 |
| 165 parameters | Extinction correction: SHELXL, FC*=KFC[1+0.001XFC2Λ3/SIN(2Θ)]-1/4 |
| 0 restraints | Extinction coefficient: 0.0158 (16) |
| Primary atom site location: structure-invariant direct methods | Absolute structure: Flack (1983), 805 Friedel pairs |
| Secondary atom site location: difference Fourier map | Absolute structure parameter: 0.02 (2) |