| 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)] = 0.032 | w = 1/[σ2(Fo2) + (0.0653P)2 + 0.7217P] where P = (Fo2 + 2Fc2)/3 |
| wR(F2) = 0.088 | (Δ/σ)max < 0.001 |
| S = 1.07 | Δρmax = 0.30 e Å−3 |
| 2776 reflections | Δρmin = −0.27 e Å−3 |
| 317 parameters | Absolute structure: Classical Flack method preferred over Parsons because s.u. lower |
| 377 restraints | Absolute structure parameter: 0.000 (16) |