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Information card for entry 1570298
Preview
| Coordinates | 1570298.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | Calcium pyrophosphate |
|---|---|
| Chemical name | dicalcium phosphonato phosphate |
| Mineral name | gamma-Ca2P2O7 |
| Formula | Ca2 O7 P2 |
| Calculated formula | Ca2 O7 P2 |
| Title of publication | Crystal Structure of γ‐Ca2P2O7 |
| Authors of publication | Sauskojus, Wolfgang; Wied, Jan K.; Litterscheid, Christian F.; Mangstl, Martin; Schmedt auf der Günne, Jörn |
| Journal of publication | Zeitschrift für anorganische und allgemeine Chemie |
| Year of publication | 2022 |
| Journal volume | 648 |
| Journal issue | 21 |
| a | 6.666 ± 0.0002 Å |
| b | 6.722 ± 0.0002 Å |
| c | 6.7374 ± 0.0002 Å |
| α | 65.113 ± 0.0018° |
| β | 87.7634 ± 0.0016° |
| γ | 85.0755 ± 0.0017° |
| Cell volume | 272.849 ± 0.015 Å3 |
| Cell temperature | 294 K |
| Ambient diffraction temperature | 294 ± 2 K |
| Ambient diffracton pressure | 1000 kPa |
| Number of distinct elements | 3 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor R(I) for significantly intense reflections | 0.9927 |
| Goodness-of-fit parameter for all reflections | 1.3569 |
| Method of determination | powder diffraction |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.5406 Å |
| Diffraction radiation type | CuKα~1~ |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 288246 (current) | 2023-12-12 | Removed the misspelt '_space_group_name_h-m' data name since the same space group information is already provided using proper data names. |
1570298.cif |
| 287560 | 2023-11-13 | cif/ Adding structures of 1570298 via cif-deposit CGI script. |
1570298.cif |
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Users of the data should acknowledge the original authors of the
structural data.