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Information card for entry 1565849
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| Coordinates | 1565849.cif |
|---|---|
| Original IUCr paper | HTML |
| Common name | blue vitriol |
|---|---|
| Chemical name | copper(II) sulfate pentahydrate |
| Formula | Cu H10 O9 S |
| Calculated formula | Cu H10 O9 S |
| Title of publication | Use of a miniature diamond-anvil cell in a joint X-ray and neutron high-pressure study on copper sulfate pentahydrate |
| Authors of publication | Novelli, Giulia; Kamenev, Konstantin V.; Maynard-Casely, Helen E.; Parsons, Simon; McIntyre, Garry J. |
| Journal of publication | IUCrJ |
| Year of publication | 2022 |
| Journal volume | 9 |
| Journal issue | 1 |
| Pages of publication | 73 - 85 |
| a | 5.9523 ± 0.0012 Å |
| b | 6.1001 ± 0.0013 Å |
| c | 10.647 ± 0.0007 Å |
| α | 77.308 ± 0.01° |
| β | 82.353 ± 0.01° |
| γ | 72.64 ± 0.01° |
| Cell volume | 359.02 ± 0.11 Å3 |
| Cell temperature | 295 ± 2 K |
| Ambient diffraction temperature | 295 ± 2 K |
| Ambient diffracton pressure | 0.71 kPa |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Weighted residual factors for all reflections included in the refinement | 0.1599 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.998 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 271674 (current) | 2022-01-01 | cif/ Adding structures of 1565849, 1565850, 1565851, 1565852 via cif-deposit CGI script. |
1565849.cif |
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