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Information card for entry 7040271
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Coordinates | 7040271.cif |
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Original paper (by DOI) | HTML |
Chemical name | 1[SbF6]2 |
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Formula | C18 H21 F12 Fe N7 S3 Sb2 |
Calculated formula | C18 H21 F12 Fe N7 S3 Sb2 |
SMILES | [Sb](F)(F)(F)(F)(F)[F-].[Sb](F)(F)(F)(F)([F-])F.[Fe]12345[n]6c(scc6)C=[N]1CCN(CC[N]3=Cc1scc[n]21)CC[N]5=Cc1scc[n]41 |
Title of publication | Thiazolylimines as novel ligand-systems for spin-crossover centred near room temperature. |
Authors of publication | Struch, N.; Wagner, N.; Schnakenburg, G.; Weisbarth, R.; Klos, S.; Beck, J.; Lützen, A |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2016 |
Journal volume | 45 |
Journal issue | 36 |
Pages of publication | 14023 - 14029 |
a | 10.0709 ± 0.0009 Å |
b | 10.0709 ± 0.0009 Å |
c | 49.888 ± 0.004 Å |
α | 90° |
β | 90° |
γ | 120° |
Cell volume | 4381.9 ± 0.7 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 K |
Number of distinct elements | 7 |
Space group number | 170 |
Hermann-Mauguin space group symbol | P 65 |
Hall space group symbol | P 65 |
Residual factor for all reflections | 0.017 |
Residual factor for significantly intense reflections | 0.0168 |
Weighted residual factors for significantly intense reflections | 0.0381 |
Weighted residual factors for all reflections included in the refinement | 0.0382 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.192 |
Diffraction radiation probe | x-ray |
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/7040271.html
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