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Information card for entry 4001361
Preview
| Coordinates | 4001361.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C Ca O3 |
|---|---|
| Calculated formula | C Ca O3 |
| SMILES | C(=O)([O-])[O-].[Ca+2] |
| Title of publication | Atomic Structure of Biogenic Aragonite |
| Authors of publication | Pokroy, B.; Fieramosca, J. S.; Von Dreele, R. B.; Fitch, A. N.; Caspi, E. N.; Zolotoyabko, E. |
| Journal of publication | Chemistry of Materials |
| Year of publication | 2007 |
| Journal volume | 19 |
| Journal issue | 13 |
| Pages of publication | 3244 |
| a | 4.96524 ± 0.00006 Å |
| b | 7.96358 ± 0.0001 Å |
| c | 5.7484 ± 0.00005 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 227.298 ± 0.004 Å3 |
| Number of distinct elements | 3 |
| Space group number | 62 |
| Hermann-Mauguin space group symbol | P m c n |
| Hall space group symbol | -P 2n 2a |
| Method of determination | powder diffraction |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178377 (current) | 2016-03-21 | cif/4/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/00. |
4001361.cif |
| 120073 | 2014-07-11 | Adding DOIs to range 4/00 structures. | 4001361.cif |
| 45208 | 2012-03-20 | ../uploads/cif-deposit/cod/cif Adding structures of 4001361, 4001362 via cif-deposit CGI script. |
4001361.cif |
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Users of the data should acknowledge the original authors of the
structural data.