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Information card for entry 4106919
Preview
Coordinates | 4106919.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C53 H56 Fe2 N24 O9 S4 |
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Calculated formula | C53 H56 Fe2 N24 O9 S4 |
Title of publication | Spin Transition Charted in a Fluorophore-Tagged Thermochromic Dinuclear Iron(II) Complex |
Authors of publication | Yann Garcia; François Robert; Anil D. Naik; Guangyuan Zhou; Bernard Tinant; Koen Robeyns; Sébastien Michotte; Luc Piraux |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2011 |
Journal volume | 133 |
Pages of publication | 15850 - 15853 |
a | 19.287 ± 0.005 Å |
b | 17.924 ± 0.005 Å |
c | 19.221 ± 0.005 Å |
α | 90° |
β | 111.26 ± 0.02° |
γ | 90° |
Cell volume | 6192 ± 3 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 6 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0549 |
Residual factor for significantly intense reflections | 0.048 |
Weighted residual factors for significantly intense reflections | 0.1217 |
Weighted residual factors for all reflections included in the refinement | 0.1267 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.062 |
Diffraction radiation wavelength | 0.71069 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/4106919.html
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Users of the data should acknowledge the original authors of the
structural data.