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Information card for entry 1506169
Preview
| Coordinates | 1506169.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C26 H40 N2 O8 S2 |
|---|---|
| Calculated formula | C26 H40 N2 O8 S2 |
| Title of publication | Anomalous anthracene arrangement and rare excimer emission in the solid state: transcription and translation of molecular information. |
| Authors of publication | Mizobe, Yuji; Miyata, Mikiji; Hisaki, Ichiro; Hasegawa, Yasuchika; Tohnai, Norimitsu |
| Journal of publication | Organic letters |
| Year of publication | 2006 |
| Journal volume | 8 |
| Journal issue | 19 |
| Pages of publication | 4295 - 4298 |
| a | 10.389 ± 0.002 Å |
| b | 11.02 ± 0.002 Å |
| c | 14.128 ± 0.002 Å |
| α | 88.08 ± 0.01° |
| β | 73.29 ± 0.01° |
| γ | 69.02 ± 0.01° |
| Cell volume | 1442.1 ± 0.5 Å3 |
| Cell temperature | 213.2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for significantly intense reflections | 0.087 |
| Weighted residual factors for all reflections included in the refinement | 0.2231 |
| Goodness-of-fit parameter for all reflections included in the refinement | 2.141 |
| Diffraction radiation wavelength | 1.5419 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176435 (current) | 2016-02-14 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries from ranges 1, 2. |
1506169.cif |
| 120071 | 2014-07-11 | Adding DOIs to range 1 structures. | 1506169.cif |
| 48055 | 2012-03-26 | ../uploads/cif-deposit/cod/cif Adding structures of 1506169 via cif-deposit CGI script. |
1506169.cif |
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Users of the data should acknowledge the original authors of the
structural data.