| Refinement on F2 | Primary atom site location: structure-invariant direct methods |
| Least-squares matrix: full | Secondary atom site location: difference Fourier map |
| R[F2 > 2σ(F2)] = 0.032 | w = 1/[σ2(Fo2) + (0.044P)2 + 0.3679P] where P = (Fo2 + 2Fc2)/3 |
| wR(F2) = 0.081 | (Δ/σ)max < 0.001 |
| S = 1.17 | Δρmax = 1.95 e Å−3 |
| 181 reflections | Δρmin = −2.53 e Å−3 |
| 10 parameters | Extinction correction: SHELXTL (Sheldrick, 2008), Fc*=kFc[1+0.001xFc2λ3/sin(2θ)]-1/4 |
| 0 restraints | Extinction coefficient: 0.038 (9) |