Information card for entry 4505344

Structure parameters

• Formula: C22 H16 Cl2 Hg Mn N6
• Calculated formula: C22 H16 Cl2 Hg Mn N6
• SMILES: C(#N)[Hg]1(C#N)[Cl][Mn]23([n]4ccccc4c4cccc[n]24)([n]2ccccc2c2cccc[n]32)[Cl]1
• Title of publication: Tuning the Structures of Mercury Cyanide-Based Coordination Polymers with Transition Metal Cations
• Authors of publication: Draper, Neil D.; Batchelor, Raymond J.; Leznoff, Daniel B.
• Journal of publication: Crystal Growth & Design
• Year of publication: 2004
• Journal volume: 4
• Journal issue: 3
• Pages of publication: 621
• a: 16.0707 ± 0.0015 Å
• b: 9.014 ± 0.001 Å
• c: 16.252 ± 0.002 Å
• α: 90°
• β: 90.127 ± 0.008°
• γ: 90°
• Cell volume: 2354.3 ± 0.4 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/c 1
• Hall space group symbol: -I 2yc
• Residual factor for significantly intense reflections: 0.0197
• Weighted residual factors for all reflections included in the refinement: 0.0252
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0768
• Diffraction radiation wavelength: 0.7093 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No