Information card for entry 7017729

Structure parameters

• Chemical name: Trans-bis[1-(2-amino-ethyl)-piperidine]dinitro-nickel(II)
• Formula: C14 H32 N6 Ni O4
• Calculated formula: C14 H32 N6 Ni O4
• Title of publication: Photocrystallographic identification of metastable nitrito linkage isomers in a series of nickel(II) complexes.
• Authors of publication: Brayshaw, Simon K.; Easun, Timothy L.; George, Michael W.; Griffin, Alexandra M. E.; Johnson, Andrew L.; Raithby, Paul R.; Savarese, Teresa L.; Schiffers, Stefanie; Warren, John E.; Warren, Mark R.; Teat, Simon J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 1
• Pages of publication: 90 - 97
• a: 9.629 ± 0.005 Å
• b: 8.24 ± 0.002 Å
• c: 11.804 ± 0.002 Å
• α: 90°
• β: 109.03 ± 0.02°
• γ: 90°
• Cell volume: 885.4 ± 0.5 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 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: 0.0481
• Residual factor for significantly intense reflections: 0.0434
• Weighted residual factors for significantly intense reflections: 0.1151
• Weighted residual factors for all reflections included in the refinement: 0.1178
• Goodness-of-fit parameter for all reflections included in the refinement: 1.109
• Diffraction radiation wavelength: 0.7749 Å
• Diffraction radiation type: MoKa
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No