Information card for entry 7202305

Structure parameters

• Formula: C6 H10 Cl4 N4 Zn
• Calculated formula: C6 H10 Cl4 N4 Zn
• SMILES: [Zn](Cl)(Cl)([Cl-])[Cl-].[nH]1c[nH+]cc1.[nH]1c[nH+]cc1
• Title of publication: Solid state synthesis of coordination compounds from basic metal salts
• Authors of publication: Adams, Christopher J.; Kurawa, Mukhtar A.; Lusi, Matteo; Orpen, A. Guy
• Journal of publication: CrystEngComm
• Year of publication: 2008
• Journal volume: 10
• Journal issue: 12
• Pages of publication: 1790
• a: 7.5859 ± 0.0019 Å
• b: 13.524 ± 0.003 Å
• c: 12.804 ± 0.003 Å
• α: 90°
• β: 93.434 ± 0.005°
• γ: 90°
• Cell volume: 1311.2 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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: 0.1332
• Residual factor for significantly intense reflections: 0.0496
• Weighted residual factors for significantly intense reflections: 0.0802
• Weighted residual factors for all reflections included in the refinement: 0.1006
• Goodness-of-fit parameter for all reflections included in the refinement: 0.972
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No