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Information card for entry 4077581
Preview
Coordinates | 4077581.cif |
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Original paper (by DOI) | HTML |
Formula | C35 H23 Fe2 O6 P |
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Calculated formula | C35 H23 Fe2 O6 P |
SMILES | [Fe]123([Fe]4(C1([C]2(=[CH]3C(=C)[P]4(c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1)(C#[O])(C#[O])C#[O])(C#[O])(C#[O])C#[O] |
Title of publication | Reactions of Alkynes with [Fe2(CO)6(μ-PPh2){μ-η1:η2α,β-(H)CαCβCγH2}]: Formation of Diphenylvinylphosphine-Functionalized Vinyl Carbenes via Carbon−Carbon and Carbon−Phosphorus Bond Formation and Hydrogen Migration⊥ |
Authors of publication | Doherty, Simon; Hogarth, Graeme; Waugh, Mark; Clegg, William; Elsegood, Mark R. J. |
Journal of publication | Organometallics |
Year of publication | 2000 |
Journal volume | 19 |
Journal issue | 22 |
Pages of publication | 4557 |
a | 20.8592 ± 0.0012 Å |
b | 10.3433 ± 0.0006 Å |
c | 28.1509 ± 0.0015 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 6073.6 ± 0.6 Å3 |
Cell temperature | 160 ± 2 K |
Ambient diffraction temperature | 160 ± 2 K |
Number of distinct elements | 5 |
Space group number | 61 |
Hermann-Mauguin space group symbol | P b c a |
Hall space group symbol | -P 2ac 2ab |
Residual factor for all reflections | 0.0693 |
Residual factor for significantly intense reflections | 0.0415 |
Weighted residual factors for significantly intense reflections | 0.074 |
Weighted residual factors for all reflections included in the refinement | 0.0833 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.046 |
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/4077581.html
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