Information card for entry 7117442

Structure parameters

• Common name: LLM-1-131B
• Formula: C25 H20 Cu N2 O5
• Calculated formula: C25 H20 Cu N2 O5
• Title of publication: A supramolecular approach for designing emissive solid-state carbazole arrays.
• Authors of publication: Lifshits, Liubov M.; Noll, Bruce C.; Klosterman, Jeremy K.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2015
• Journal volume: 51
• Journal issue: 58
• Pages of publication: 11603 - 11606
• a: 27.7412 ± 0.0011 Å
• b: 11.114 ± 0.0005 Å
• c: 15.0069 ± 0.0006 Å
• α: 90°
• β: 102.921 ± 0.002°
• γ: 90°
• Cell volume: 4509.7 ± 0.3 ų
• Cell temperature: 299 ± 2 K
• Ambient diffraction temperature: 299 ± 2 K
• Number of distinct elements: 5
• 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: 0.0432
• Residual factor for significantly intense reflections: 0.0405
• Weighted residual factors for significantly intense reflections: 0.1092
• Weighted residual factors for all reflections included in the refinement: 0.112
• Goodness-of-fit parameter for all reflections included in the refinement: 1.102
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No