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CIF Information Card
Information card for 7205749
7205748 << 7205749 >> 7205750Preview
|
Coordinates |
7205749.cif |
Structure parameters
| Formula | - B6 Br K3 O10 - |
| Calculated formula | - B6 Br K3 O10 - |
| Title of publication | Crystal growth and optical properties of a noncentrosymmetric haloid borate, K3B6O10Br |
| Authors of publication | Zhang, Min; Pan, Shi-Lie; Fan, Xiao-Yun; Zhou, Zhong-Xiang; Poeppelmeier, Kenneth R.; Yang, Yun |
| Journal of publication | CrystEngComm |
| Year of publication | 2011 |
| Journal volume | 13 |
| Journal issue | 8 |
| Pages of publication | 2899 |
| a | 10.1153 ± 0.0008 Å |
| b | 10.1153 ± 0.0008 Å |
| c | 8.8592 ± 0.0014 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 785.02 ± 0.15 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Hermann-Mauguin symmetry space group | R 3 m :H |
| Hall symmetry space group | R 3 -2" |
| Residual factor for all reflections | 0.0275 |
| Residual factor for observed reflections | 0.0273 |
| Weighted residual factors for the observed reflections | 0.0637 |
| Weighted residual factors for all reflections included in the refinement | 0.0639 |
| Goodness-of-fit parameter for observed reflections | 1.157 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |