| Refinement on F2 | w = 1/[σ2(Fo2) + (0.1P)2] where P = (Fo2 + 2Fc2)/3 |
| R[F2 > 2σ(F2)] = 0.037 | (Δ/σ)max < 0.001 |
| wR(F2) = 0.038 | Δρmax = 0.48 e Å−3 |
| S = 1.25 | Δρmin = −0.37 e Å−3 |
| 2752 reflections | Absolute structure: Flack (1983), with 1292 Friedel pairs |
| 215 parameters | Flack parameter: −0.02 (4) |
| H atoms treated by a mixture of independent and constrained refinement |