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Information card for entry 7035830
Preview
Coordinates | 7035830.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C37 H45 Cl Fe P2 Si2 |
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Calculated formula | C37 H45 Cl Fe P2 Si2 |
SMILES | [Fe]12345(Cl)([P](CC[P]1(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)[c]1([cH]2[c]3([cH]4[cH]51)[Si](C)(C)C)[Si](C)(C)C |
Title of publication | Synthesis and characterisation of halide, separated ion pair, and hydride cyclopentadienyl iron bis(diphenylphosphino)ethane derivatives. |
Authors of publication | Patel, Dipti; Wooles, Ashley; Cornish, Andrew D.; Steven, Lindsey; Davies, E. Stephen; Evans, David J.; McMaster, Jonathan; Lewis, William; Blake, Alexander J.; Liddle, Stephen T. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2015 |
Journal volume | 44 |
Journal issue | 31 |
Pages of publication | 14159 - 14177 |
a | 13.064 ± 0.005 Å |
b | 11.869 ± 0.005 Å |
c | 22.546 ± 0.009 Å |
α | 90° |
β | 91.632 ± 0.009° |
γ | 90° |
Cell volume | 3494 ± 2 Å3 |
Cell temperature | 90 ± 2 K |
Ambient diffraction temperature | 90 ± 2 K |
Number of distinct elements | 6 |
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 | 0.1313 |
Residual factor for significantly intense reflections | 0.0959 |
Weighted residual factors for significantly intense reflections | 0.198 |
Weighted residual factors for all reflections included in the refinement | 0.2131 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.125 |
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/7035830.html
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