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Information card for entry 7006577
Preview
Coordinates | 7006577.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C70 H91 N17 O12 S4 Zn4 |
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Calculated formula | C70 H91 N17 O12 S4 Zn4 |
Title of publication | Controlled formation and topologies of thiophenolate-based macrocycles: rings, cylinders and bowls. |
Authors of publication | Christensen, Aase; Mayer, Christoph; Jensen, Frank; Bond, Andrew D.; McKenzie, Christine J. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2006 |
Journal issue | 1 |
Pages of publication | 108 - 120 |
a | 15.567 ± 0.002 Å |
b | 22.548 ± 0.003 Å |
c | 26.568 ± 0.003 Å |
α | 107.85 ± 0.003° |
β | 103.482 ± 0.003° |
γ | 102.425 ± 0.003° |
Cell volume | 8207.7 ± 1.8 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 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 | 0.2123 |
Residual factor for significantly intense reflections | 0.1007 |
Weighted residual factors for significantly intense reflections | 0.2526 |
Weighted residual factors for all reflections included in the refinement | 0.3139 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.067 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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The link is: https://www.crystallography.net/7006577.html
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Users of the data should acknowledge the original authors of the
structural data.