Skip to main content
. 2008 Jul 19;64(Pt 8):o1533. doi: 10.1107/S1600536808021855
Refinement on F2 Secondary atom site location: difference Fourier map
Least-squares matrix: full Hydrogen site location: difference Fourier map
R[F2 > 2σ(F2)] = 0.034 All H-atom parameters refined
wR(F2) = 0.084   w = 1/[σ2(Fo2) + (0.0427P)2 + 0.2178P] where P = (Fo2 + 2Fc2)/3
S = 1.03 (Δ/σ)max < 0.001
3351 reflections Δρmax = 0.23 e Å3
327 parameters Δρmin = −0.18 e Å3
Primary atom site location: structure-invariant direct methods Extinction correction: none