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Information card for entry 7038216
Preview
Coordinates | 7038216.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C20 H32 B2 F8 Fe N8 S4 |
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Calculated formula | C20 H32 B2 F8 Fe N8 S4 |
Title of publication | Synthesis, characterization, DFT calculations, and electrochemical comparison of novel iron(ii) complexes with thione and selone ligands. |
Authors of publication | Stadelman, Bradley S.; Kimani, Martin M.; Bayse, Craig A.; McMillen, Colin D.; Brumaghim, Julia L. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2016 |
Journal volume | 45 |
Journal issue | 11 |
Pages of publication | 4697 - 4711 |
a | 12.022 ± 0.002 Å |
b | 21.648 ± 0.004 Å |
c | 12.825 ± 0.003 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 3337.7 ± 1.1 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 7 |
Space group number | 60 |
Hermann-Mauguin space group symbol | P b c n |
Hall space group symbol | -P 2n 2ab |
Residual factor for all reflections | 0.055 |
Residual factor for significantly intense reflections | 0.0481 |
Weighted residual factors for significantly intense reflections | 0.1305 |
Weighted residual factors for all reflections included in the refinement | 0.1417 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.099 |
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/7038216.html
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