Refinement on F2 | 37 constraints |
Least-squares matrix: full | H atoms treated by a mixture of independent and constrained refinement |
R[F2 > 2σ(F2)] = 0.033 | w = 1/[σ2(Fo2) + (0.0429P)2 + 0.6045P] where P = (Fo2 + 2Fc2)/3 |
wR(F2) = 0.087 | (Δ/σ)max = −0.0003 |
S = 1.04 | Δρmax = 0.27 e Å−3 |
3589 reflections | Δρmin = −0.21 e Å−3 |
268 parameters | Extinction correction: SHELXL2019/2 (Sheldrick, 2015b), Fc*=kFc[1+0.001xFc2λ3/sin(2θ)]-1/4 |
0 restraints | Extinction coefficient: 0.0012 (2) |