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Information card for entry 4068904
Preview
Coordinates | 4068904.cif |
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Original paper (by DOI) | HTML |
Formula | C34.25 H43.5 B Cl0.5 F4 N2 O Ru |
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Calculated formula | C34.25 H43.5 B Cl0.5 F4 N2 O Ru |
Title of publication | Sequential Formation of [Ru(IPr)2(CO)H(OH2)]+and [Ru(IPr)(η6-C6H6)(CO)H]+upon Protonation of Ru(IPr)2(CO)H(OH) (IPr = 1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene) |
Authors of publication | Saker, Olly; Mahon, Mary F.; Warren, John E.; Whittlesey, Michael K. |
Journal of publication | Organometallics |
Year of publication | 2009 |
Journal volume | 28 |
Journal issue | 6 |
Pages of publication | 1976 |
a | 9.704 ± 0.004 Å |
b | 18.093 ± 0.008 Å |
c | 19.237 ± 0.008 Å |
α | 91.981 ± 0.005° |
β | 96.119 ± 0.005° |
γ | 93.59 ± 0.005° |
Cell volume | 3349 ± 2 Å3 |
Cell temperature | 120 ± 2 K |
Ambient diffraction temperature | 120 ± 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 | 0.1551 |
Residual factor for significantly intense reflections | 0.0816 |
Weighted residual factors for significantly intense reflections | 0.1845 |
Weighted residual factors for all reflections included in the refinement | 0.2112 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.051 |
Diffraction radiation wavelength | 0.6943 Å |
Diffraction radiation type | synchrotron |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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