Synchrotron PXRD with Pawley fit
Zn-HAB_NEt3 / TEA 9 equiv as-synthesised powder · Powder
PXRD at beamline 17-BM, Advanced Photon Source; wavelength 0.45260 angstrom; Pawley fit in TOPAS using space group I4122.
| Property | Reported value | Normalised value | Uncertainty | Origin and quality | Source |
|---|---|---|---|---|---|
| Unit cell aMarked as a best value within this paper | 21.7(1) A | — | (1) | SI Table Exact Reported | S6 · Structural determination · Table S1 |
| Unit cell cMarked as a best value within this paper | 23.5(3) A | — | (3) | SI Table Exact Reported | S6 · Structural determination · Table S1 |
| Refined/formula assignment | C24N24Zn6 | — | — | SI Table Exact Reported | S6 · Structural determination · Table S1 |
| Pawley fit Rwp | 0.00700 | — | — | SI Table Exact Reported | S6 · Structural determination · Table S1 |
| First strongest PXRD peak d-spacing | 15.50 A | — | — | Text Rounded Reported | 2 · Structure characterisation · Figure 2b |
| Space groupMarked as a best value within this paper | I4122 | — | — | SI Table Exact Reported | S6 · Structural determination · Table S1 |