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Information card for entry 7029138
Preview
Coordinates | 7029138.cif |
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Original paper (by DOI) | HTML |
Formula | C13 H18 Fe I P |
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Calculated formula | C13 H18 Fe I P |
SMILES | [c]12([cH]3[cH]4[cH]5[cH]1[Fe]16782345[cH]2[cH]1[cH]6[cH]7[cH]82)[P+](C)(C)C.[I-] |
Title of publication | Ferrocenyl-phosphonium ionic liquids - synthesis, characterisation and electrochemistry. |
Authors of publication | Kübler, Paul; Sundermeyer, Jörg |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2014 |
Journal volume | 43 |
Journal issue | 9 |
Pages of publication | 3750 - 3766 |
a | 20.3608 ± 0.0013 Å |
b | 20.3608 ± 0.0013 Å |
c | 20.3608 ± 0.0013 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 8440.8 ± 0.9 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
Space group number | 205 |
Hermann-Mauguin space group symbol | P a -3 |
Hall space group symbol | -P 2ac 2ab 3 |
Residual factor for all reflections | 0.1088 |
Residual factor for significantly intense reflections | 0.0297 |
Weighted residual factors for significantly intense reflections | 0.032 |
Weighted residual factors for all reflections included in the refinement | 0.0418 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.475 |
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/7029138.html
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