Information card for entry 1571379

Structure parameters

• Formula: C5 H6 Cl2 Cu N4
• Calculated formula: C5 H6 Cl2 Cu N4
• Title of publication: Interplay of Isomorphs and Polymorphs of Amidino-Copper(II) Complexes with Different Halides
• Authors of publication: Yamba, Zaina; Peoble, Anna; Novikov, Egor; Castañeda, Raúl; Timofeeva, Tatiana
• Journal of publication: Crystals
• Year of publication: 2024
• Journal volume: 14
• Journal issue: 4
• Pages of publication: 319
• a: 8.71 ± 0.006 Å
• b: 6.292 ± 0.005 Å
• c: 15.26 ± 0.011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 836.3 ± 1.1 ų
• Cell temperature: 100.15 K
• Ambient diffraction temperature: 100.15 K
• Number of distinct elements: 5
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0767
• Residual factor for significantly intense reflections: 0.0697
• Weighted residual factors for significantly intense reflections: 0.1601
• Weighted residual factors for all reflections included in the refinement: 0.1624
• Goodness-of-fit parameter for all reflections included in the refinement: 1.344
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No