Information card for entry 7042607

Structure parameters

• Formula: C37 H34 Cu N4 O2
• Calculated formula: C37 H34 Cu N4 O2
• SMILES: [Cu]123n4cccc4C(=c4[n]1ccc4)c1ccccc1OCCCCCCCOc1ccccc1C(=c1[n]2ccc1)c1n3ccc1
• Title of publication: Spacer length dependent architectural diversity in bis-dipyrrin copper(ii) complexes.
• Authors of publication: Paitandi, Rajendra Prasad; Singh, Roop Shikha; Mukhopadhyay, Sujay; Kumar, Ashish; Pandey, Daya Shankar
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2017
• Journal volume: 46
• Journal issue: 16
• Pages of publication: 5420 - 5430
• a: 14.9525 ± 0.0003 Å
• b: 15.1818 ± 0.0003 Å
• c: 27.7558 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6300.7 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0741
• Residual factor for significantly intense reflections: 0.0544
• Weighted residual factors for significantly intense reflections: 0.1378
• Weighted residual factors for all reflections included in the refinement: 0.1524
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No