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Information card for entry 4082127
Preview
Coordinates | 4082127.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C43 H60 Cl F6 N6 O P Ru |
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Calculated formula | C43 H60 Cl F6 N6 O P Ru |
SMILES | [c]12([cH]3[Ru]45671(Cl)(c1[n+](nn(C)c1c1n(C)n[n+](c41)c1c(C(C)C)cccc1C(C)C)c1c(C(C)C)cccc1C(C)C)[c](C)([cH]35)[cH]7[cH]26)C(C)C.O=C(C)C.[P](F)(F)(F)(F)(F)[F-] |
Title of publication | Arene‒Ruthenium(II) and −Iridium(III) Complexes with “Click”-Based Pyridyl-triazoles, Bis-triazoles, and Chelating Abnormal Carbenes: Applications in Catalytic Transfer Hydrogenation of Nitrobenzene |
Authors of publication | Hohloch, Stephan; Suntrup, Lisa; Sarkar, Biprajit |
Journal of publication | Organometallics |
Year of publication | 2013 |
Journal volume | 32 |
Journal issue | 24 |
Pages of publication | 7376 |
a | 14.212 ± 0.004 Å |
b | 18.02 ± 0.005 Å |
c | 17.412 ± 0.005 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 4459 ± 2 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 8 |
Space group number | 33 |
Hermann-Mauguin space group symbol | P n a 21 |
Hall space group symbol | P 2c -2n |
Residual factor for all reflections | 0.0641 |
Residual factor for significantly intense reflections | 0.0552 |
Weighted residual factors for significantly intense reflections | 0.1319 |
Weighted residual factors for all reflections included in the refinement | 0.1374 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.142 |
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/4082127.html
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Users of the data should acknowledge the original authors of the
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