Refinement on F2 | 0 restraints |
Least-squares matrix: full | Hydrogen site location: inferred from neighbouring sites |
R[F2 > 2σ(F2)] = 0.086 | H-atom parameters constrained |
wR(F2) = 0.282 | w = 1/[σ2(Fo2) + (0.0956P)2] where P = (Fo2 + 2Fc2)/3 |
S = 0.95 | (Δ/σ)max < 0.001 |
3593 reflections | Δρmax = 0.49 e Å−3 |
228 parameters | Δρmin = −0.32 e Å−3 |