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Information card for entry 2312593
Preview
Coordinates | 2312593.cif |
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Structure factors | 2312593.hkl |
Original IUCr paper | HTML |
Chemical name | (Acetato-κ<i>O</i>)bis(2,2'-bipyridine-κ^2^<i>N</i>,<i>N</i>')copper(II) acetate–acetic acid–water (1/1/3) |
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Formula | C26 H32 Cu N4 O9 |
Calculated formula | C26 H32 Cu N4 O9 |
Title of publication | Coordination structure and intermolecular interactions in copper(II) acetate complexes with 1,10-phenanthroline and 2,2'-bipyridine. |
Authors of publication | Guimaraes, Samuel P.; Dos Santos, Leonardo H. R.; Rodrigues, Bernardo L. |
Journal of publication | Acta crystallographica. Section C, Structural chemistry |
Year of publication | 2024 |
Journal volume | 80 |
Journal issue | 9 |
a | 11.0826 ± 0.0018 Å |
b | 11.184 ± 0.0019 Å |
c | 12.188 ± 0.0018 Å |
α | 86.537 ± 0.001° |
β | 69.82 ± 0.001° |
γ | 83.261 ± 0.001° |
Cell volume | 1407.8 ± 0.4 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0363 |
Residual factor for significantly intense reflections | 0.0296 |
Weighted residual factors for significantly intense reflections | 0.079 |
Weighted residual factors for all reflections included in the refinement | 0.0815 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.053 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
Revision | Date | Message | Files |
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294214 (current) | 2024-08-24 | cif/ hkl/ Adding structures of 2312592, 2312593 via cif-deposit CGI script. |
2312593.cif 2312593.hkl |
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Users of the data should acknowledge the original authors of the
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