| Refinement on F2 | Hydrogen site location: mixed |
| Least-squares matrix: full | H atoms treated by a mixture of independent and constrained refinement |
| R[F2 > 2σ(F2)] = 0.040 | w = 1/[σ2(Fo2) + (0.0457P)2 + 0.4848P] where P = (Fo2 + 2Fc2)/3 |
| wR(F2) = 0.111 | (Δ/σ)max = 0.001 |
| S = 1.03 | Δρmax = 0.17 e Å−3 |
| 3934 reflections | Δρmin = −0.15 e Å−3 |
| 242 parameters | Extinction correction: SHELXL, Fc*=kFc[1+0.001xFc2λ3/sin(2θ)]-1/4 |
| 0 restraints | Extinction coefficient: 0.0175 (15) |
| Primary atom site location: difference Fourier map |