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Information card for entry 4308789
Preview
Coordinates | 4308789.cif |
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Original paper (by DOI) | HTML |
Formula | C30 H32 N6 O4 Ru |
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Calculated formula | C30 H32 N6 O4 Ru |
SMILES | C1(=CC(C)=[O][Ru]2([n]3ccccc3Nc3ncccc3)(O1)([n]1ccccc1Nc1ncccc1)[O]=C(C)C=C(C)O2)C |
Title of publication | Unusual Monodentate Binding Mode of 2,2'-Dipyridylamine (L) in Isomeric trans-(acac)2RuII(L)2, trans-[(acac)2RuIII(L)2]ClO4, and cis-(acac)2RuII(L)2 (acac = Acetylacetonate). Synthesis, Structures, and Spectroscopic, Electrochemical, and Magnetic Aspects |
Authors of publication | Sanjib Kar; Nripen Chanda; Shaikh M. Mobin; Francisco A. Urbanos; Mark Niemeyer; Vedavati G. Puranik; Reyes Jimenez-Aparicio; Goutam Kumar Lahiri |
Journal of publication | Inorganic Chemistry |
Year of publication | 2005 |
Journal volume | 44 |
Pages of publication | 1571 - 1579 |
a | 11.243 ± 0.0015 Å |
b | 12.025 ± 0.0018 Å |
c | 21.839 ± 0.002 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 2952.6 ± 0.7 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
Space group number | 52 |
Hermann-Mauguin space group symbol | P c n n |
Hall space group symbol | -P 2ab 2c |
Residual factor for all reflections | 0.1929 |
Residual factor for significantly intense reflections | 0.0539 |
Weighted residual factors for significantly intense reflections | 0.086 |
Weighted residual factors for all reflections included in the refinement | 0.1162 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.992 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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