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Information card for entry 4070077
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Coordinates | 4070077.cif |
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Original paper (by DOI) | HTML |
Chemical name | (carbonyl)(triphenylphosphine)(1,3-tetramethyl-1,2-di-silabutyl)(trimethylsylylcyclopentadienyl)iron(III) |
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Formula | C36 H48 Fe O P Si3 |
Calculated formula | C36 H48 Fe O P Si3 |
Title of publication | The Utility of Sodium Diisopropylamide (NADA): Formation of a New Transition Metalate via Silyl Migration Chemistry, [(η5-Me3SiC5H4)Fe(CO)(PPh3)]−Na+(SiFpPNa), and Resulting Thermal Rearrangements of the Complexes SiFpP−CH2SiMe2R (R = H, SiMe3) to SiFpP−SiMe2CH2R |
Authors of publication | Munguia, Teresita; Bakir, Zaynab A.; Cervantes-Lee, Francisco; Metta-Magana, Alejandro; Pannell, Keith H. |
Journal of publication | Organometallics |
Year of publication | 2009 |
Journal volume | 28 |
Journal issue | 19 |
Pages of publication | 5777 |
a | 9.2515 ± 0.0009 Å |
b | 18.0499 ± 0.0016 Å |
c | 22.205 ± 0.002 Å |
α | 90° |
β | 94.349 ± 0.002° |
γ | 90° |
Cell volume | 3697.3 ± 0.6 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0816 |
Residual factor for significantly intense reflections | 0.0628 |
Weighted residual factors for significantly intense reflections | 0.138 |
Weighted residual factors for all reflections included in the refinement | 0.1483 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.093 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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