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Information card for entry 4071681
Preview
Coordinates | 4071681.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C44 H30 N8 Na2 |
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Calculated formula | C44 H30 N8 Na2 |
SMILES | [Na]123([n]4cccc5Cc6ccc[n]1c6c45)[n]1cccc4=CC5=CC=C[N]2([Na]26([n]7cccc8Cc9ccc[n]2c9c78)[n]2cccc7=CC8=CC=C[N]36C8=c27)C5=c14 |
Title of publication | Syntheses, Characterizations, and Reactivities of 4,5-Diazafluorenide Complexes of Palladium(II) and Rhodium(I) |
Authors of publication | Jiang, Huiling; Song, Datong |
Journal of publication | Organometallics |
Year of publication | 2008 |
Journal volume | 27 |
Journal issue | 14 |
Pages of publication | 3587 |
a | 14.418 ± 0.0006 Å |
b | 15.3044 ± 0.0007 Å |
c | 16.7139 ± 0.0008 Å |
α | 90° |
β | 109.206 ± 0.002° |
γ | 90° |
Cell volume | 3482.8 ± 0.3 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 4 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.1307 |
Residual factor for significantly intense reflections | 0.0518 |
Weighted residual factors for significantly intense reflections | 0.1139 |
Weighted residual factors for all reflections included in the refinement | 0.149 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.986 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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