Skip to main content
. 2013 Oct 16;69(Pt 11):o1642. doi: 10.1107/S1600536813027827
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)] = 0.065 Hydrogen site location: inferred from neighbouring sites
wR(F2) = 0.139 H-atom parameters constrained
S = 1.17 w = 1/[σ2(Fo2) + (0.0417P)2 + 1.8852P] where P = (Fo2 + 2Fc2)/3
1528 reflections (Δ/σ)max < 0.001
110 parameters Δρmax = 0.26 e Å3
0 restraints Δρmin = −0.26 e Å3