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Information card for entry 7015914
Preview
Coordinates | 7015914.cif |
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Original paper (by DOI) | HTML |
Formula | C25 H20 Cl2 N5 O Rh |
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Calculated formula | C25 H20 Cl2 N5 O Rh |
SMILES | c1(ccccc1)[N]1=Nc2cccc3N=[N](c4ccccc4)[Rh]1([O]=C(c1ccccc1)N)(c23)(Cl)Cl |
Title of publication | Formation of organorhodium complexes via C-H bond activation of 1,3-di(phenylazo)benzene. |
Authors of publication | Majumder, Paramita; Baksi, Suparna; Halder, Sarmistha; Tadesse, Haregewine; Blake, Alexander J.; Drew, Michael G. B.; Bhattacharya, Samaresh |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2011 |
Journal volume | 40 |
Journal issue | 20 |
Pages of publication | 5423 - 5425 |
a | 12.1868 ± 0.0011 Å |
b | 12.088 ± 0.0005 Å |
c | 15.7543 ± 0.0006 Å |
α | 90° |
β | 92.597 ± 0.006° |
γ | 90° |
Cell volume | 2318.4 ± 0.2 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 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 | 0.1006 |
Residual factor for significantly intense reflections | 0.0543 |
Weighted residual factors for significantly intense reflections | 0.1268 |
Weighted residual factors for all reflections included in the refinement | 0.153 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.803 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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