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Information card for entry 8000088
Preview
| Coordinates | 8000088.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C44 H38 Fe O12 |
|---|---|
| Calculated formula | C44 H38 Fe O12 |
| Title of publication | A Novel Molecular Structure of a Ferrocene Derivative Containing Mesogenic Group, 1,1′-Bis[2-[4-(4-methoxyphenoxycarbonyl)phenoxy]ethoxycarbonyl]ferrocene |
| Authors of publication | Nakamura, Naotake; Nishikawa, Masako |
| Journal of publication | Chemistry Letters |
| Year of publication | 2005 |
| Journal volume | 34 |
| Journal issue | 11 |
| Pages of publication | 1544 |
| a | 27.701 ± 0.004 Å |
| b | 9.011 ± 0.002 Å |
| c | 15.172 ± 0.004 Å |
| α | 90° |
| β | 98.781 ± 0.016° |
| γ | 90° |
| Cell volume | 3742.8 ± 1.4 Å3 |
| Cell temperature | 296.1 K |
| Number of distinct elements | 4 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for significantly intense reflections | 0.0363 |
| Weighted residual factors for all reflections included in the refinement | 0.0684 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.016 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176466 (current) | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 8. |
8000088.cif |
| 94244 | 2014-01-22 | cif/ Adding structures of 8000088 via cif-deposit CGI script. |
8000088.cif |
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Users of the data should acknowledge the original authors of the
structural data.