Fig. 3: Single-crystal structures of target molecules 1–25, 40–56 and 58–62 in EtP5-MOF-2.
From: Supramolecular docking structure determination of alkyl-bearing molecules
Refined crystal structures of the target molecules obtained from SCXRD data shown with 50% probability thermal ellipsoids. Only the pillar[5]arene units of EtP5-MOF-2 (presented in ball and stick form in khaki) are shown for clarity. In the case of positional disorder, only one conformation of target molecules is shown for clarity. Colour code for target molecules: C atoms are dark grey, H atoms are light grey, O atoms are red, N atoms are blue, F atoms are green, Br atoms are brown, S atoms are luminous yellow and Si atom is light blue.
