Information card for entry 2204830

Structure parameters

• Chemical name: Tris(ethylenediamine-κ^2^N,N')zinc(II) bis(1,2-dicyanoethylenedithiolato-κ^2^S,S')nickelate(II)
• Formula: C14 H24 N10 Ni S4 Zn
• Calculated formula: C14 H24 N10 Ni S4 Zn
• SMILES: C(#N)C1=C(C#N)S[Ni]2(S1)SC(=C(C#N)S2)C#N.C1C[NH2][Zn]23([NH2]1)([NH2]CC[NH2]3)[NH2]CC[NH2]2
• Title of publication: Tris(ethylenediamine-κ^2^<i>N,N</i>')zinc(II) bis(1,2-dicyanoethylenedithiolato-κ^2^<i>S,S</i>')nickelate(II)
• Authors of publication: Ai-Yun Fu; Da-Qi Wang; Yu, Tao
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 12
• Pages of publication: m1939 - m1940
• a: 8.743 ± 0.001 Å
• b: 17.0087 ± 0.0019 Å
• c: 16.3138 ± 0.0017 Å
• α: 90°
• β: 98.982 ± 0.003°
• γ: 90°
• Cell volume: 2396.2 ± 0.5 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 6
• 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: 0.114
• Residual factor for significantly intense reflections: 0.049
• Weighted residual factors for significantly intense reflections: 0.064
• Weighted residual factors for all reflections included in the refinement: 0.07
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes