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Information card for entry 2009287
Preview
Coordinates | 2009287.cif |
---|---|
Structure factors | 2009287.hkl |
Original IUCr paper | HTML |
Common name | Cu NH3 Ni(CN)4, 23611 |
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Chemical name | decaammine-5k^3^N,6k^2^N,7k^2^N,8k^3^N-octa-m-cyano-1:5k^2^C:N;1:6k^2^C:N; 2:6k^2^C:N;2:7k^2^C:N;3:6k^2^C:N;3:7k^2^C:N;4:7k^2^C:N;4:8k^2^C:N-octacyano- 1k^2^C,2k^2^C,3k^2^C,4k^2^C-tetracopper(II)tetranickel(II) |
Formula | C16 H36 Cu4 N28 Ni4 |
Calculated formula | C16 H36 Cu4 N28 Ni4 |
SMILES | [Cu]([NH3])([NH3])([NH3])([NH3])[N]#C[Ni](C#[N][Cu]1([NH3])([NH3])[N]#C[Ni](C#[N][Cu]([NH3])([NH3])([N]#C[Ni](C#N)(C#[N][Cu]([NH3])([NH3])([NH3])[NH3])C#N)[N]#C[Ni](C#[N]1)(C#N)C#N)(C#N)C#N)(C#N)C#N |
Title of publication | A molecular tetraamminecopper(II)-<i>trans</i>-diamminecopper(II) tetracyanonickelate(II) coordination compound |
Authors of publication | Janiak, Christoph; Wu, He-Ping; Klüfers, Peter; Mayer, Peter |
Journal of publication | Acta Crystallographica Section C |
Year of publication | 1999 |
Journal volume | 55 |
Journal issue | 12 |
Pages of publication | 1966 - 1969 |
a | 16.8265 ± 0.0013 Å |
b | 15.7626 ± 0.0013 Å |
c | 7.2886 ± 0.0005 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1933.2 ± 0.3 Å3 |
Cell temperature | 200 ± 2 K |
Ambient diffraction temperature | 200 ± 2 K |
Number of distinct elements | 5 |
Space group number | 58 |
Hermann-Mauguin space group symbol | P n n m |
Hall space group symbol | -P 2 2n |
Residual factor for all reflections | 0.061 |
Residual factor for significantly intense reflections | 0.033 |
Weighted residual factors for all reflections included in the refinement | 0.073 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.854 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
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The link is: https://www.crystallography.net/2009287.html
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