| 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)] = 0.029 | w = 1/[σ2(Fo2) + (0.0215P)2] where P = (Fo2 + 2Fc2)/3 |
| wR(F2) = 0.058 | (Δ/σ)max = 0.001 |
| S = 1.02 | Δρmax = 0.87 e Å−3 |
| 2458 reflections | Δρmin = −0.65 e Å−3 |
| 117 parameters | Absolute structure: Refined as an inversion twin |
| 7 restraints | Absolute structure parameter: −0.07 (4) |
| Primary atom site location: structure-invariant direct methods |