| Refinement on F2 | Hydrogen site location: inferred from neighbouring sites |
| Least-squares matrix: full | H-atom parameters constrained |
| R[F2 > 2σ(F2)] = 0.064 | w = 1/[σ2(Fo2) + (0.035P)2 + 1.3721P] where P = (Fo2 + 2Fc2)/3 |
| wR(F2) = 0.166 | (Δ/σ)max < 0.001 |
| S = 1.15 | Δρmax = 0.30 e Å−3 |
| 4580 reflections | Δρmin = −0.26 e Å−3 |
| 308 parameters | Extinction correction: SHELXTL (Sheldrick, 2008), Fc*=kFc[1+0.001xFc2λ3/sin(2θ)]-1/4 |
| Primary atom site location: structure-invariant direct methods | Extinction coefficient: 0.021 (4) |
| Secondary atom site location: difference Fourier map |