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Information card for entry 7234915
Preview
Coordinates | 7234915.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C8 H11 B F4 N2 O2 |
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Calculated formula | C8 H11 B F4.0005 N2 O2 |
Title of publication | Strong piezoelectricity in [H-beta-(2-pyridyl)-Ala-OH][BF4] and [H-beta-(2-pyridyl)-Ala-OH][ClO4] - new amino acid based hybrid crystals |
Authors of publication | Maciej Wojtas; Anna Gagor; Andrei L. Kholkin |
Journal of publication | Journal of Materials Chemistry C |
Year of publication | 2016 |
Journal volume | 4 |
Pages of publication | 7622 - 7631 |
a | 5.012 ± 0.0002 Å |
b | 9.4413 ± 0.0004 Å |
c | 11.0484 ± 0.0005 Å |
α | 88.242 ± 0.004° |
β | 80.518 ± 0.003° |
γ | 89.255 ± 0.003° |
Cell volume | 515.41 ± 0.04 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 6 |
Space group number | 1 |
Hermann-Mauguin space group symbol | P 1 |
Hall space group symbol | P 1 |
Residual factor for all reflections | 0.0495 |
Residual factor for significantly intense reflections | 0.0468 |
Weighted residual factors for significantly intense reflections | 0.1174 |
Weighted residual factors for all reflections included in the refinement | 0.1201 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.156 |
Diffraction radiation probe | x-ray |
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/7234915.html
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structural data.