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Information card for entry 4119606
Preview
Coordinates | 4119606.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C64 H62 Br8 Cl4 Fe4 N32 O9 |
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Calculated formula | C64 H40 Br8 Cl4 Fe4 N32 O9 |
Title of publication | Spin Transitions in Fe(II) Metallogrids Modulated by Substituents, Counteranions, and Solvents |
Authors of publication | Yi-Tong Wang; Shu-Tao Li; Shu-Qi Wu; Ai-Li Cui; De-Zhong Shen; Hui-Zhong Kou |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2013 |
Journal volume | 135 |
Pages of publication | 5942 - 5945 |
a | 23.685 ± 0.003 Å |
b | 23.685 ± 0.003 Å |
c | 23.685 ± 0.003 Å |
α | 100.291 ± 0.017° |
β | 100.291 ± 0.017° |
γ | 100.291 ± 0.017° |
Cell volume | 12555 ± 3 Å3 |
Cell temperature | 153 ± 2 K |
Ambient diffraction temperature | 153 ± 2 K |
Number of distinct elements | 7 |
Space group number | 167 |
Hermann-Mauguin space group symbol | R -3 c :R |
Hall space group symbol | -P 3* 2n |
Residual factor for all reflections | 0.1402 |
Residual factor for significantly intense reflections | 0.1332 |
Weighted residual factors for significantly intense reflections | 0.2793 |
Weighted residual factors for all reflections included in the refinement | 0.2849 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.021 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4119606.html
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