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Information card for entry 4114589
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Jmol._Canvas2D (Jmol) "jmolApplet0"[x]
Coordinates | 4114589.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C52 H49 B F20 N2 Ru2 |
---|---|
Calculated formula | C52 H49 B F20 N2 Ru2 |
SMILES | [RuH]1234567([Ru]89%10%11%12%13([N]1(=[C]9([N]28C(C)C)C)C(C)C)([c]1([c]%13([c]%12([c]%11([c]%101C)C)C)C)C)[H]7)[c]1([c]6([c]5([c]4([c]31C)C)C)C)C.Fc1c(c(F)c(F)c(F)c1F)[B-](c1c(F)c(F)c(F)c(F)c1F)(c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F |
Title of publication | Novel Coordinatively Unsaturated Bimetallic Complexes, [(η5-C5Me5)Ru(μ2-iPrNC(Me)NiPr)Ru(η5-C5Me5)]+: A Bridging Amidinate Ligand Perpendicular to the Metal-Metal Axis Effectively Stabilizes the Highly Reactive Cationic Diruthenium Species |
Authors of publication | Hideo Kondo; Kouki Matsubara; Hideo Nagashima |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2002 |
Journal volume | 124 |
Pages of publication | 534 - 535 |
a | 14.1154 ± 0.0003 Å |
b | 15.3888 ± 0.0003 Å |
c | 23.4856 ± 0.0007 Å |
α | 90° |
β | 93.466 ± 0.0009° |
γ | 90° |
Cell volume | 5092.2 ± 0.2 Å3 |
Cell temperature | 183 ± 2 K |
Ambient diffraction temperature | 183 ± 2 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0481 |
Residual factor for significantly intense reflections | 0.0417 |
Weighted residual factors for significantly intense reflections | 0.1248 |
Weighted residual factors for all reflections included in the refinement | 0.1316 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.217 |
Diffraction radiation wavelength | 0.71069 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4114589.html
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Users of the data should acknowledge the original authors of the
structural data.