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Information card for entry 7114445
Preview
Coordinates | 7114445.cif |
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Original paper (by DOI) | HTML |
Formula | C104 H72 Cu4 N8 O20 |
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Calculated formula | C104 H72 Cu4 N8 O20 |
Title of publication | Interlocking of molecular rhombi into a 2D polyrotaxane network via π‒π interactions. Crystal structure of [Cu2(bpa)2(phen)2(H2O)]2·2H2O (bpa2‒ = biphenyl-4,4′-dicarboxylate, phen = 1,10-phenanthroline) |
Authors of publication | Liu, Gao-Feng; Ye, Bao-Hui; Ling, Yong-Hua; Chen, Xiao-Ming |
Journal of publication | Chemical Communications |
Year of publication | 2002 |
Journal issue | 14 |
Pages of publication | 1442 |
a | 23.358 ± 0.005 Å |
b | 15.008 ± 0.003 Å |
c | 25.479 ± 0.005 Å |
α | 90 ± 0.02° |
β | 90 ± 0.02° |
γ | 90 ± 0.02° |
Cell volume | 8932 ± 3 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
Space group number | 61 |
Hermann-Mauguin space group symbol | P b c a |
Hall space group symbol | -P 2ac 2ab |
Residual factor for all reflections | 0.0832 |
Residual factor for significantly intense reflections | 0.0501 |
Weighted residual factors for significantly intense reflections | 0.118 |
Weighted residual factors for all reflections included in the refinement | 0.1413 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.034 |
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/7114445.html
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