Information card for entry 7008888

Structure parameters

• Formula: C10 H20 Cl2 N6 Ni O9 S4
• Calculated formula: C10 H20 Cl2 N6 Ni O9 S4
• Title of publication: Nickel(II) complexes with dithiadiiminoamine and dithiabis(thiosemicarbazone) ligands †
• Authors of publication: Pavlishchuk, Vitaly V.; Kolotilov, Sergey V.; Addison, Anthony W.; Butcher, Raymond J.; Sinn, Ekkehard
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 3
• Pages of publication: 335
• a: 7.6487 ± 0.0016 Å
• b: 14.789 ± 0.003 Å
• c: 21.618 ± 0.005 Å
• α: 90°
• β: 97.399 ± 0.016°
• γ: 90°
• Cell volume: 2425 ± 0.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0818
• Residual factor for significantly intense reflections: 0.0508
• Weighted residual factors for significantly intense reflections: 0.1127
• Weighted residual factors for all reflections included in the refinement: 0.1281
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No