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Information card for entry 1504399
Preview
Coordinates | 1504399.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C85 H109 Mn6 N7 O26 S2 |
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Calculated formula | C85 H109 Mn6 N7 O26 S2 |
Title of publication | Grafting derivatives of Mn6 single-molecule magnets with high anisotropy energy barrier on Au111 surface. |
Authors of publication | Moro, F.; Corradini, V.; Evangelisti, M.; De Renzi, V.; Biagi, R.; del Pennino, U.; Milios, C. J.; Jones, L. F.; Brechin, E. K. |
Journal of publication | The journal of physical chemistry. B |
Year of publication | 2008 |
Journal volume | 112 |
Journal issue | 32 |
Pages of publication | 9729 - 9735 |
a | 12.8647 ± 0.0005 Å |
b | 13.1373 ± 0.0005 Å |
c | 16.1689 ± 0.0006 Å |
α | 92.116 ± 0.002° |
β | 101.617 ± 0.002° |
γ | 114.076 ± 0.002° |
Cell volume | 2422.07 ± 0.17 Å3 |
Cell temperature | 150 K |
Ambient diffraction temperature | 150 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 | 0.1349 |
Residual factor for significantly intense reflections | 0.0847 |
Weighted residual factors for all reflections | 0.0925 |
Weighted residual factors for significantly intense reflections | 0.0785 |
Weighted residual factors for all reflections included in the refinement | 0.0785 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.0236 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/1504399.html
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Users of the data should acknowledge the original authors of the
structural data.