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Information card for entry 4324511
Preview
Coordinates | 4324511.cif |
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Original paper (by DOI) | HTML |
Formula | C25 H19 Cl N4 O3 Ru |
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Calculated formula | C25 H19 Cl N4 O3 Ru |
SMILES | C1(=O)c2ccc3ccccc3[n]2[Ru]23([n]4ccccc4c4cccc(c5cccc[n]35)[n]24)(O1)Cl.O |
Title of publication | Isomeric Complexes of [RuII(trpy)(L)Cl] (trpy = 2,2':6',2''-Terpyridine and HL = Quinaldic Acid): Preference of Isomeric Structural Form in Catalytic Chemoselective Epoxidation Process |
Authors of publication | Abhishek Dutta Chowdhury; Amit Das; Irshad K; Shaikh M. Mobin; Goutam Kumar Lahiri |
Journal of publication | Inorganic Chemistry |
Year of publication | 2011 |
Journal volume | 50 |
Pages of publication | 1775 - 1785 |
a | 14.5284 ± 0.0003 Å |
b | 16.8813 ± 0.0004 Å |
c | 8.9158 ± 0.0002 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 2186.67 ± 0.08 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 6 |
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 | 0.0362 |
Residual factor for significantly intense reflections | 0.0271 |
Weighted residual factors for significantly intense reflections | 0.0442 |
Weighted residual factors for all reflections included in the refinement | 0.0454 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.904 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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