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Information card for entry 4067938
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Coordinates | 4067938.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | NaB(C6H5)4 |
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Chemical name | Sodium tetraphenylborate at 295 K |
Formula | C24 H20 B Na |
Calculated formula | C24 H20 B Na |
SMILES | [B-](c1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1.[Na+] |
Title of publication | Solid-State Structures of Base-Free Lithium and Sodium Tetraphenylborates at Room and Low Temperature: Comparison with the Higher Homologues MB(C6H5)4(M = K, Rb, Cs) |
Authors of publication | Behrens, Ulrich; Hoffmann, Frank; Olbrich, Falk |
Journal of publication | Organometallics |
Year of publication | 2012 |
Journal volume | 31 |
Journal issue | 3 |
Pages of publication | 905 |
a | 11.477 ± 0.001 Å |
b | 11.477 ± 0.001 Å |
c | 7.4405 ± 0.0014 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 980.1 ± 0.2 Å3 |
Cell temperature | 295 K |
Ambient diffraction temperature | 295 K |
Number of distinct elements | 4 |
Space group number | 121 |
Hermann-Mauguin space group symbol | I -4 2 m |
Hall space group symbol | I -4 2 |
Residual factor for all reflections | 0.0365 |
Residual factor for significantly intense reflections | 0.0359 |
Weighted residual factors for significantly intense reflections | 0.1032 |
Weighted residual factors for all reflections included in the refinement | 0.1037 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.002 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4067938.html
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