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Information card for entry 1518561
Preview
| Coordinates | 1518561.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C7 H6 Cs I O3 |
|---|---|
| Calculated formula | C7 H4 Cs I O3 |
| Title of publication | Mesophases and Ionic Conductivities of Simple Organic Salts of M(m-Iodobenzoate) (M = Li(+), Na(+), K(+), Rb(+), and Cs(+)). |
| Authors of publication | Endo, Manami; Nakane, Yuta; Takahashi, Kiyonori; Hoshino, Norihisa; Takeda, Takashi; Noro, Shin-Ichiro; Nakamura, Takayoshi; Akutagawa, Tomoyuki |
| Journal of publication | The journal of physical chemistry. B |
| Year of publication | 2015 |
| Journal volume | 119 |
| Journal issue | 4 |
| Pages of publication | 1768 - 1777 |
| a | 19.6351 ± 0.0003 Å |
| b | 4.13863 ± 0.0001 Å |
| c | 12.4789 ± 0.0002 Å |
| α | 90° |
| β | 106.518 ± 0.001° |
| γ | 90° |
| Cell volume | 972.22 ± 0.03 Å3 |
| Cell temperature | 119 K |
| Ambient diffraction temperature | 119 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.1074 |
| Residual factor for significantly intense reflections | 0.1028 |
| Weighted residual factors for significantly intense reflections | 0.2447 |
| Weighted residual factors for all reflections included in the refinement | 0.248 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.063 |
| Diffraction radiation wavelength | 1.54187 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176729 (current) | 2016-02-18 | cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1. |
1518561.cif |
| 130754 | 2015-02-04 | cif/ Updating files of 1518557, 1518558, 1518559, 1518560, 1518561 Original log message: Adding full bibliography for 1518557--1518561.cif. |
1518561.cif |
| 129923 | 2015-01-17 | cif/ Adding structures of 1518557, 1518558, 1518559, 1518560, 1518561 via cif-deposit CGI script. |
1518561.cif |
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Users of the data should acknowledge the original authors of the
structural data.