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Information card for entry 7005242
Preview
Coordinates | 7005242.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C42 H44 Cl4 F6 O4 P3 Ru |
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Calculated formula | C42 H44 Cl4 F6 O4 P3 Ru |
SMILES | CC1=CC(C)=[O][Ru]2(O1)([P](C#CC)(c1ccccc1)c1ccccc1)(OC(=CC(C)=[O]2)C)[P](C#CC)(c1ccccc1)c1ccccc1.[P](F)(F)(F)(F)(F)[F-].ClCCl.C(Cl)Cl |
Title of publication | Bis(acetylacetonato)ruthenium(II) complexes containing alkynyldiphenylphosphines. Formation and redox behaviour of [Ru(acac)2(Ph2PC triple bond CR)2] (R=H, Me, Ph) complexes and the binuclear complex cis-[{Ru(acac)2}2(micro-Ph2PC triple bond CPPh2)}2]. |
Authors of publication | Bennett, Martin A.; Byrnes, Matthew J.; Willis, Anthony C. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2007 |
Journal issue | 17 |
Pages of publication | 1677 - 1686 |
a | 9.79 ± 0.0009 Å |
b | 11.1192 ± 0.0008 Å |
c | 11.1518 ± 0.0009 Å |
α | 104.946 ± 0.006° |
β | 93.248 ± 0.007° |
γ | 97.52 ± 0.007° |
Cell volume | 1157.6 ± 0.17 Å3 |
Cell temperature | 193.2 K |
Ambient diffraction temperature | 193.2 K |
Number of distinct elements | 7 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0573 |
Residual factor for significantly intense reflections | 0.036 |
Weighted residual factors for all reflections | 0.0452 |
Weighted residual factors for significantly intense reflections | 0.0414 |
Weighted residual factors for all reflections included in the refinement | 0.0414 |
Goodness-of-fit parameter for all reflections | 1.306 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.362 |
Diffraction radiation wavelength | 1.5418 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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