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Information card for entry 4333992
Preview
Coordinates | 4333992.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C5 F3 K2.7 O15 Pb5.15 |
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Calculated formula | C5 F2.98 K2.7 O15 Pb5.15 |
Title of publication | New Fluoride Carbonates: Centrosymmetric KPb2(CO3)2F and Noncentrosymmetric K2.70Pb5.15(CO3)5F3 |
Authors of publication | T. Thao Tran; P. Shiv Halasyamani |
Journal of publication | Inorganic Chemistry |
Year of publication | 2013 |
Journal volume | 52 |
Pages of publication | 2466 - 2473 |
a | 5.3052 ± 0.0002 Å |
b | 5.3052 ± 0.0002 Å |
c | 18.5904 ± 0.001 Å |
α | 90° |
β | 90° |
γ | 120° |
Cell volume | 453.13 ± 0.03 Å3 |
Cell temperature | 295 ± 2 K |
Ambient diffraction temperature | 295 ± 2 K |
Number of distinct elements | 5 |
Space group number | 187 |
Hermann-Mauguin space group symbol | P -6 m 2 |
Hall space group symbol | P -6 2 |
Residual factor for all reflections | 0.0169 |
Residual factor for significantly intense reflections | 0.0169 |
Weighted residual factors for significantly intense reflections | 0.0478 |
Weighted residual factors for all reflections included in the refinement | 0.0478 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.186 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
176467 (current) | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4. |
4333992.cif |
99801 | 2014-02-03 | cif/ Adding structures of 4333992 via cif-deposit CGI script. |
4333992.cif |
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Users of the data should acknowledge the original authors of the
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