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Information card for entry 2212352
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Coordinates | 2212352.cif |
---|---|
Structure factors | 2212352.hkl |
Original IUCr paper | HTML |
Chemical name | Dichloro(μ~4~-oxalato-1κ^2^O,O':2κ^2^O'',O''')bis{[1-(pyridin-2- yl)ethylidene]hydrazine-κ^2^N,N'}dicopper(II) |
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Formula | C16 H18 Cl2 Cu2 N6 O4 |
Calculated formula | C16 H18 Cl2 Cu2 N6 O4 |
SMILES | c1c[n]2[Cu]3([N](=C(c2cc1)C)N)([O]=C1C(=[O][Cu]2([n]4c(cccc4)C(C)=[N]2N)(O1)Cl)O3)Cl |
Title of publication | μ-Oxalato-1κ^2^<i>O</i>,<i>O</i>':2κ^2^<i>O</i>'',<i>O</i>'''-bis(chloro{[1-(2-pyridyl-κ<i>N</i>)ethylidene]hydrazine-κ<i>N</i>}copper(II)) |
Authors of publication | Stefaniya V. Tomyn; Elźbieta Gumienna-Kontecka; Igor O. Fritsky; Turganbay S. Iskenderov; Jolanta Światek-Kozłowska |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2007 |
Journal volume | 63 |
Journal issue | 2 |
Pages of publication | m438 - m440 |
a | 9.3785 ± 0.0006 Å |
b | 9.2002 ± 0.0006 Å |
c | 11.2501 ± 0.0008 Å |
α | 90° |
β | 100.422 ± 0.006° |
γ | 90° |
Cell volume | 954.69 ± 0.11 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0438 |
Residual factor for significantly intense reflections | 0.0369 |
Weighted residual factors for significantly intense reflections | 0.0948 |
Weighted residual factors for all reflections included in the refinement | 0.0986 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.092 |
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/2212352.html
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