Information card for entry 7711735

Structure parameters

• Formula: C36 H40 Cl2 Cu2 N6 O14
• Calculated formula: C36 H40 Cl2 Cu2 N6 O14
• Title of publication: Effect of the flexible chain length of a dimetal subunit on the formation of 1D coordination polymers to molecular rectangles
• Authors of publication: Gogia, Alisha; Khullar, Sadhika; Chanda, Alokananda; Mandal, Sanjay K.
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 30.897 ± 0.005 Å
• b: 11.6403 ± 0.0015 Å
• c: 24.473 ± 0.004 Å
• α: 90°
• β: 100.67 ± 0.011°
• γ: 90°
• Cell volume: 8650 ± 2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.2025
• Residual factor for significantly intense reflections: 0.1485
• Weighted residual factors for significantly intense reflections: 0.3783
• Weighted residual factors for all reflections included in the refinement: 0.4164
• Goodness-of-fit parameter for all reflections included in the refinement: 1.406
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No