Information card for entry 7102837

Structure parameters

• Formula: C16 H30 Br4 Mn N4
• Calculated formula: C16 H30 Br4 Mn N4
• SMILES: c1n(cc[n+]1C)CCCC.Br[Mn](Br)([Br-])[Br-].c1n(cc[n+]1C)CCCC
• Title of publication: Structure and magnetic behavior of transition metal based ionic liquids
• Authors of publication: Del Sesto, Rico E.; McCleskey, T. Mark; Burrell, Anthony K.; Baker, Gary A.; Thompson, Joe D.; Scott, Brian L.; Wilkes, John S.; Williams, Peg
• Journal of publication: Chemical Communications (Cambridge, United Kingdom)
• Year of publication: 2008
• Journal issue: 4
• Pages of publication: 447 - 449
• a: 15.024 ± 0.0017 Å
• b: 9.407 ± 0.0011 Å
• c: 18.726 ± 0.002 Å
• α: 90°
• β: 112.442 ± 0.001°
• γ: 90°
• Cell volume: 2446.2 ± 0.5 ų
• Cell temperature: 141 ± 2 K
• Ambient diffraction temperature: 141 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0417
• Residual factor for significantly intense reflections: 0.0301
• Weighted residual factors for significantly intense reflections: 0.0704
• Weighted residual factors for all reflections included in the refinement: 0.0743
• Goodness-of-fit parameter for all reflections included in the refinement: 1.218
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No