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Information card for entry 2232126
Preview
Coordinates | 2232126.cif |
---|---|
Structure factors | 2232126.hkl |
Original IUCr paper | HTML |
Chemical name | {<i>N</i>'-[1-(2-Pyridyl)ethylidene-κ<i>N</i>]benzohydrazidato-κ^2^<i>N</i>',\ <i>O</i>}{<i>N</i>'-[1-(2-pyridyl)ethylidene-κ<i>N</i>]benzohydrazide-\ κ^2^<i>N</i>',<i>O</i>}copper(II) trichloroacetate |
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Formula | C30 H25 Cl3 Cu N6 O4 |
Calculated formula | C30 H25 Cl3 Cu N6 O4 |
SMILES | c1cccc2C(C)=[N]3N=C(c4ccccc4)O[Cu]453([n]12)[n]1ccccc1C(C)=[N]4NC(c1ccccc1)=[O]5.C(C(=O)[O-])(Cl)(Cl)Cl |
Title of publication | {<i>N</i>'-[1-(2-Pyridyl)ethylidene-κ<i>N</i>]benzohydrazidato-κ^2^<i>N</i>',<i>O</i>}{<i>N</i>'-[1-(2-pyridyl)ethylidene-κ<i>N</i>]benzohydrazide-κ^2^<i>N</i>',<i>O</i>}copper(II) trichloroacetate |
Authors of publication | Datta, Amitabha; Chuang, Nien-Tsu; Wen, Yun-Sheng; Huang, Jui-Hsien; Sheu, Shiann-Cherng |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2011 |
Journal volume | 67 |
Journal issue | 10 |
Pages of publication | m1388 |
a | 8.3341 ± 0.0006 Å |
b | 13.047 ± 0.0009 Å |
c | 16.0729 ± 0.0012 Å |
α | 107.737 ± 0.001° |
β | 102.541 ± 0.001° |
γ | 95.259 ± 0.001° |
Cell volume | 1601.3 ± 0.2 Å3 |
Cell temperature | 295 ± 2 K |
Ambient diffraction temperature | 295 ± 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 | 0.0705 |
Residual factor for significantly intense reflections | 0.0585 |
Weighted residual factors for significantly intense reflections | 0.176 |
Weighted residual factors for all reflections included in the refinement | 0.1888 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.03 |
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/2232126.html
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