From discrete molecule, to polymer, to MOF: mapping the coordination chemistry of CdII using 113Cd solid-state NMRElectronic supplementary information (ESI) available: Synthetic procedures, 1H, 13C and 15N SS-NMR spectra, single crystal X-ray crystallography experimental data tables, PXRD data and DFT methodology. CCDC 1485135-1485136. For ESI and crystallographic data in CIF or other electronic format see DOI: 10.1039/c6cc04940k

Studies of three related Cd II systems (a discrete [Cd II 2 ] unit, a one-dimensional [Cd II 2 ] n coordination polymer and a Cd II -based MOF) all derived from the ligand 2,4,6-tris(2-pyrimidyl)-1,3,5-triazine, reveal an exceptionally rare example of 113 Cd- 113 Cd J coupling in the polymer that is...

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Main Authors: Frost, Jamie M, Kobera, Libor, Pialat, Amélie, Zhang, Yixin, Southern, Scott A, Gabidullin, Bulat, Bryce, David L, Murugesu, Muralee
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Summary:Studies of three related Cd II systems (a discrete [Cd II 2 ] unit, a one-dimensional [Cd II 2 ] n coordination polymer and a Cd II -based MOF) all derived from the ligand 2,4,6-tris(2-pyrimidyl)-1,3,5-triazine, reveal an exceptionally rare example of 113 Cd- 113 Cd J coupling in the polymer that is detectable by solid-state NMR ( 2 J Cd-Cd = ∼65 Hz). Studies of three related Cd II systems derived from the ligand 2,4,6-tris(2-pyrimidyl)-1,3,5-triazine, reveal an exceptionally rare example of 113 Cd- 113 Cd J coupling that is detectable by solid-state NMR ( 2 J Cd-Cd = ∼65 Hz).
ISSN:1359-7345
1364-548X
DOI:10.1039/c6cc04940k