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Information card for entry 2212764
Preview
Coordinates | 2212764.cif |
---|---|
Structure factors | 2212764.hkl |
Original IUCr paper | HTML |
Chemical name | Bis{N-[bis(6-bromopyridin-2-yl)methylene-κN]ethane-1,2-diamine- κ^2^N,N'}nickel(II) bis(perchlorate) |
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Formula | C26 H24 Br4 Cl2 N8 Ni O8 |
Calculated formula | C26 H24 Br4 Cl2 N8 Ni O8 |
SMILES | C1(c2cccc(n2)Br)c2cccc([n]2[Ni]234([N]=1CC[NH2]2)[n]1c(C(c2cccc(n2)Br)=[N]3CC[NH2]4)cccc1Br)Br.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O |
Title of publication | Bis{<i>N</i>-[bis(6-bromopyridin-2-yl)methylene-κ<i>N</i>]ethane-1,2-diamine-κ^2^<i>N</i>,<i>N</i>'}nickel(II) bis(perchlorate) |
Authors of publication | Knight, James C.; Amoroso, Angelo J.; Prabaharan, Ravi; Edwards, Peter G. |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2007 |
Journal volume | 63 |
Journal issue | 4 |
Pages of publication | m1046 - m1047 |
a | 9.1897 ± 0.0003 Å |
b | 12.9937 ± 0.0003 Å |
c | 15.0869 ± 0.0005 Å |
α | 110.077 ± 0.002° |
β | 95.308 ± 0.002° |
γ | 94.573 ± 0.002° |
Cell volume | 1672.76 ± 0.09 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 7 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1171 |
Residual factor for significantly intense reflections | 0.0638 |
Weighted residual factors for significantly intense reflections | 0.1288 |
Weighted residual factors for all reflections included in the refinement | 0.1483 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.016 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2212764.html
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