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Information card for entry 7114175
Preview
Coordinates | 7114175.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C47 H38 F6 N4 O P2 Ru S3 |
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Calculated formula | C47 H38 F6 N4 O P2 Ru S3 |
SMILES | [Ru]123([P](c4ccccc4)(c4ccccc4)c4c(sc(c4)c4sccc4)c4sccc34)([n]3ccccc3c3[n]1cccc3)[n]1ccccc1c1[n]2cccc1.[P](F)(F)(F)(F)(F)[F-].O=C(C)C |
Title of publication | Switchable thiophene coordination in Ru(ii) bipyridyl phosphinoterthiophene complexesElectronic supplementary information (ESI) available: synthetic details and characterization data for all complexes. See http://www.rsc.org/suppdata/cc/b2/b209035j/ |
Authors of publication | Moorlag, Carolyn; Clot, Olivier; Wolf, Michael O.; Patrick, Brian O. |
Journal of publication | Chemical Communications |
Year of publication | 2002 |
Journal issue | 24 |
Pages of publication | 3028 |
a | 10.1989 ± 0.0003 Å |
b | 14.9169 ± 0.0005 Å |
c | 15.2939 ± 0.0003 Å |
α | 77.207 ± 0.005° |
β | 79.517 ± 0.005° |
γ | 88.763 ± 0.006° |
Cell volume | 2230.7 ± 0.12 Å3 |
Cell temperature | 173.2 K |
Ambient diffraction temperature | 173.2 K |
Number of distinct elements | 8 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0627 |
Residual factor for significantly intense reflections | 0.034 |
Weighted residual factors for all reflections | 0.0899 |
Weighted residual factors for all reflections included in the refinement | 0.0899 |
Goodness-of-fit parameter for all reflections | 1.004 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.004 |
Diffraction radiation wavelength | 0.7107 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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