Information card for entry 7201017

Structure parameters

• Formula: C15 H23 Cl2 Mn N3 O3
• Calculated formula: C15 H23 Cl2 Mn N3 O3
• SMILES: [Mn]1234(Cl)(Cl)[n]5c6cccc5C(=[N]2CC[O]4CC[O]3CC[N]1=C6C)C.O
• Title of publication: Rational design of cyanide-bridged heterometallic M(I)‒Mn(II) (M = Ag, Au) one-dimensional chain complexes: synthesis, crystal structures and magnetic properties
• Authors of publication: Zhang, Daopeng; Wang, Hailong; Tian, Laijin; Jiang, Jianzhuang; Ni, Zhong-Hai
• Journal of publication: CrystEngComm
• Year of publication: 2009
• Journal volume: 11
• Journal issue: 11
• Pages of publication: 2447
• a: 8.267 ± 0.014 Å
• b: 8.394 ± 0.013 Å
• c: 14.19 ± 0.02 Å
• α: 73.89 ± 0.02°
• β: 76.72 ± 0.02°
• γ: 81.28 ± 0.02°
• Cell volume: 917 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0869
• Residual factor for significantly intense reflections: 0.069
• Weighted residual factors for significantly intense reflections: 0.211
• Weighted residual factors for all reflections included in the refinement: 0.2394
• Goodness-of-fit parameter for all reflections included in the refinement: 1.081
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No