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Data for the X-ray structure were recorded using a Siemens SMART/CCD diffractometer at -120°C. The terminal chain disorder is even more significant when data was collected at room temperature, but the rest part of the molecule as well as the overall crystal packing are nearly not affected. Since the terminal regions of the aliphatic chains are located at the cavities created by pentiptycene groups, this indicates that the size of cavities is larger than that of their occupants, the aliphatic chains. In addition, the inevitable terminal chain disorder instead of the quality of the crystal should be responsible for the high discrepancy index values. The following are data for the crystal system, space group, unit cell parameters (Å and degree), Z, R, Rw, and GOF: triclinic, P1, a = 12.2691(2), b = 13.6644(2), c = 15.8290(2), α = 65.349(1), β = 67.588(1), γ = 82.818(1), 2, 0.0974, 0.2650, 1.079.
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