Information card for entry 4343025

Structure parameters

• Formula: C25 H23 Cu4 I4 N7
• Calculated formula: C24 H18 Cu4 I4 N6
• Title of publication: Vapochromic Luminescence and Flexibility Control of Porous Coordination Polymers by Substitution of Luminescent Multinuclear Cu(I) Cluster Nodes.
• Authors of publication: Hayashi, Takahiro; Kobayashi, Atsushi; Ohara, Hiroki; Yoshida, Masaki; Matsumoto, Takeshi; Chang, Ho-Chol; Kato, Masako
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 18
• Pages of publication: 8905 - 8913
• a: 14.765 ± 0.005 Å
• b: 17.932 ± 0.006 Å
• c: 16.285 ± 0.005 Å
• α: 90°
• β: 105.678 ± 0.003°
• γ: 90°
• Cell volume: 4151 ± 2 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0671
• Residual factor for significantly intense reflections: 0.0626
• Weighted residual factors for significantly intense reflections: 0.1697
• Weighted residual factors for all reflections included in the refinement: 0.1747
• Goodness-of-fit parameter for all reflections included in the refinement: 0.861
• Diffraction radiation wavelength: 0.6889 Å
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No