Information card for entry 2234360

Structure parameters

• Chemical name: Bis(azido-κ<i>N</i>)bis[6-(pyridin-2-yl)-1,3,5-triazine-2,4-diamine- κ^2^<i>N</i>^1^,<i>N</i>^6^]manganese(II)
• Formula: C16 H16 Mn N18
• Calculated formula: C16 H16 Mn N18
• SMILES: c1cccc2c3[n]([Mn]4([n]12)(N=N#N)([n]1ccccc1c1nc(nc([n]41)N)N)N=N#N)c(nc(n3)N)N
• Title of publication: Bis(azido-κ<i>N</i>)bis[6-(pyridin-2-yl)-1,3,5-triazine-2,4-diamine-κ^2^<i>N</i>^1^,<i>N</i>^6^]manganese(II)
• Authors of publication: Wang, Kun-Miao; Liu, Zhi-Hua; Zheng, Qi; Liu, Chun-Bo; Miao, Ming-Ming
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 4
• Pages of publication: m427
• a: 18.33 ± 0.003 Å
• b: 14.412 ± 0.003 Å
• c: 9.1915 ± 0.0017 Å
• α: 90°
• β: 115.044 ± 0.002°
• γ: 90°
• Cell volume: 2199.9 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• 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: 0.0955
• Residual factor for significantly intense reflections: 0.0464
• Weighted residual factors for significantly intense reflections: 0.088
• Weighted residual factors for all reflections included in the refinement: 0.1056
• Goodness-of-fit parameter for all reflections included in the refinement: 1.005
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes