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Synthesis and Structural Study of Some Pyrimidinium Hexafluoridosilicates

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SUPPLEMENTARY MATERIAL

Synthesis and Structural Study of Some Pyrimidinium Hexafluoridosilicates

Andrej Pevec

Faculty of Chemistry and Chemical Technology, University of Ljubljana, Večna pot 113, SI-1000 Ljubljana, Slovenia

Table S1. Numerical parameters1 for π

π interactions in the structure of 1and 3.

centroid-centroid distance (Å)

dihedral angle (°)

interplanar distance (Å)

offset angle (°) slippage (Å)

1

3.4886(9) 0 3.3592(6) 15.65 0.941

3

3.5862(13) 0 3.2213(9) 26.07 1.576

3.3590(12) 0 3.2897(9) 11.66 0.679

Reference:

1. C. Janiak, J. Chem. Soc., Dalton Trans. 2000, 3885–3896.

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Figure S1. ORTEP plot of 1 from the X-ray crystal structure with thermal ellipsoids at 50%

probability for non-H atoms and open circles for H-atoms.

Figure S2. ORTEP plot of 2 from the X-ray crystal structure with thermal ellipsoids at 50%

probability for non-H atoms and open circles for H-atoms.

Reference

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