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Information card for entry 4323567
Preview
Coordinates | 4323567.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C36 H44 Cu2 N4 O8 |
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Calculated formula | C36 H44 Cu2 N4 O8 |
SMILES | [Cu]12[Cu]3(OC(=[O]1)C1(C)C[C@@]4(C(=O)N(C(=O)[C@@](C)(C4)C1)c1cc(N4C(=O)[C@]5(C)C[C@@](C4=O)(C)CC(C(=[O]3)O2)(C)C5)c(cc1C)C)C)[N]#CC.N#CC |
Title of publication | Synthesis and Characterization of a Novel Class of Dicopper(I) Bis(carboxylate)-Bridged Complexes |
Authors of publication | Daniel D. LeCloux |
Journal of publication | Inorganic Chemistry |
Year of publication | 1997 |
Journal volume | 36 |
Pages of publication | 4035 - 4046 |
a | 13.61 ± 0.0002 Å |
b | 16.1248 ± 0.0003 Å |
c | 17.6981 ± 0.0001 Å |
α | 90° |
β | 112.21 ± 0.0007° |
γ | 90° |
Cell volume | 3595.83 ± 0.09 Å3 |
Cell temperature | 188 ± 2 K |
Ambient diffraction temperature | 188 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0434 |
Residual factor for significantly intense reflections | 0.0341 |
Weighted residual factors for all reflections | 0.0799 |
Weighted residual factors for significantly intense reflections | 0.0759 |
Goodness-of-fit parameter for all reflections | 1.047 |
Goodness-of-fit parameter for significantly intense reflections | 1.088 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4323567.html
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