view article

Figure 3
(a) Space-group diagrams displaying the symmetry of the mother C2/c (P 1) (top left), daughter P21/n (P 2) (bottom left) and P21/a (P 3) (right) phases of Form-I. The parts in light blue indicate symmetry elements that are no longer present in the new phases. (b) Overlay of the molecular skeleton of the complexes in the C2/c (P 1) (blue) and P21/n (P 2) (red) cells, illustrating the molecular distortion which occurs during the phase change (inset). (c) Overlay of the molecular skeleton of the complexes in the P21/n (1.69 GPa, blue) and P21/a (2.18 GPa, red) phases to illustrate the molecular distortion which occurs during the phase change. Note the significant movement of the C31 atom through an angle of 129° between the P21/n and P21/a phases (inset).

IUCrJ
Volume 3| Part 5| September 2016| Pages 367-376
ISSN: 2052-2525