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Information card for entry 7101434
Preview
Coordinates | 7101434.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C42 H49 B Co I N9 Se3 |
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Calculated formula | C42 H49 B Co I N9 Se3 |
SMILES | [BH]12N3C(=[Se][Co](I)([Se]=C4N1C=CN4c1c(cc(cc1C)C)C)[Se]=C1N2C=CN1c1c(cc(cc1C)C)C)N(C=C3)c1c(cc(cc1C)C)C.CC#N.CC#N.CC#N |
Title of publication | Synthesis and Structural Characterization of Tris(2-seleno-1-mesitylimidazolyl)hydroborato Complexes: A New Type of Strongly Electron Donating Tripodal Selenium Ligand |
Authors of publication | G. Parkin; Victoria K. Landry; Luciano Marchio; Jonathan G. Melnick; Mao Minoura; Keliang Pang |
Journal of publication | Chemical Communications |
Year of publication | 2006 |
Journal issue | 38 |
a | 14.7744 ± 0.0008 Å |
b | 14.7744 ± 0.0008 Å |
c | 38.319 ± 0.002 Å |
α | 90° |
β | 90° |
γ | 120° |
Cell volume | 7243.7 ± 0.7 Å3 |
Cell temperature | 243 ± 2 K |
Ambient diffraction temperature | 243 ± 2 K |
Number of distinct elements | 7 |
Space group number | 148 |
Hermann-Mauguin space group symbol | R -3 :H |
Hall space group symbol | -R 3 |
Residual factor for all reflections | 0.0392 |
Residual factor for significantly intense reflections | 0.0307 |
Weighted residual factors for significantly intense reflections | 0.0793 |
Weighted residual factors for all reflections included in the refinement | 0.083 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.016 |
Diffraction radiation wavelength | 0.71073 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/7101434.html
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Users of the data should acknowledge the original authors of the
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