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Information card for entry 4085512
Preview
Coordinates | 4085512.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C19 H36 Fe Si5 |
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Calculated formula | C19 H36 Fe Si5 |
SMILES | [c]123[cH]4[cH]5[cH]6[cH]1[Fe]17892456[c]2([cH]1[cH]7[cH]8[cH]92)[SiH]3[Si]([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C |
Title of publication | Tuning the Polymerization Behavior of Silicon-Bridged [1]Ferrocenophanes Using Bulky Substituents |
Authors of publication | Musgrave, Rebecca A.; Russell, Andrew D.; Whittell, George R.; Haddow, Mairi F.; Manners, Ian |
Journal of publication | Organometallics |
Year of publication | 2015 |
Journal volume | 34 |
Journal issue | 5 |
Pages of publication | 897 |
a | 8.993 ± 0.007 Å |
b | 12.953 ± 0.009 Å |
c | 21.509 ± 0.016 Å |
α | 90° |
β | 93.103 ± 0.014° |
γ | 90° |
Cell volume | 2502 ± 3 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 4 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0362 |
Residual factor for significantly intense reflections | 0.0263 |
Weighted residual factors for significantly intense reflections | 0.0619 |
Weighted residual factors for all reflections included in the refinement | 0.0668 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.051 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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