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CIF Information Card
Information card for 1100939
1100938 << 1100939 >> 1100940Preview
|
Coordinates |
1100939.cif |
Structure parameters
| Formula | - C28 H22 Cl2 N6 O4 Ru - |
| Calculated formula | - C28 H22 Cl2 N6 O4 Ru - |
| Title of publication | Effect of 2-(2-Pyridyl)azole-Based Ancillary Ligands (L1-4) on the Electrophilicity of the Nitrosyl Function in [RuII(trpy)(L1-4)(NO)]3+ [trpy = 2,2':6',2''-Terpyridine]. Synthesis, Structures, and Spectroscopic, Electrochemical, and Kinetic Aspects |
| Authors of publication | Nripen Chanda; Debamita Paul; Sanjib Kar; Shaikh M. Mobin; Anindya Datta; Vedavati G. Puranik; K. Krishnamurthy Rao; Goutam Kumar Lahiri |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2005 |
| Journal volume | 44 |
| Pages of publication | 3499 - 3511 |
| a | 14.398 ± 0.0008 Å |
| b | 12.162 ± 0.0009 Å |
| c | 15.477 ± 0.0014 Å |
| α | 90° |
| β | 92.644 ± 0.006° |
| γ | 90° |
| Cell volume | 2707.3 ± 0.4 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Hermann-Mauguin symmetry space group | P 1 21/n 1 |
| Hall symmetry space group | -P 2yn |
| Residual factor for all reflections | 0.041 |
| Residual factor for observed reflections | 0.0339 |
| Weighted residual factors for the observed reflections | 0.086 |
| Weighted residual factors for all reflections included in the refinement | 0.0934 |
| Goodness-of-fit parameter for observed reflections | 1.08 |
| Diffraction radiation wavelength | 0.7093 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |