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Information card for entry 2235799
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| Coordinates | 2235799.cif |
|---|---|
| Structure factors | 2235799.hkl |
| Original IUCr paper | HTML |
| Chemical name | 2-(Anthracen-9-yl)-10-methoxybenzo[<i>h</i>]quinoline acetone hemisolvate |
|---|---|
| Formula | C29.5 H22 N O1.5 |
| Calculated formula | C29.5 H22 N O1.5 |
| Title of publication | 2-(Anthracen-9-yl)-10-methoxybenzo[<i>h</i>]quinoline acetone hemisolvate |
| Authors of publication | Dong, Zhenming; Liu, Bo; Cui, Xinxin; Liu, Yufang |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2012 |
| Journal volume | 68 |
| Journal issue | 8 |
| Pages of publication | o2535 |
| a | 9.198 ± 0.003 Å |
| b | 10.69 ± 0.004 Å |
| c | 11.13 ± 0.004 Å |
| α | 95.224 ± 0.004° |
| β | 91.484 ± 0.005° |
| γ | 94.064 ± 0.005° |
| Cell volume | 1086.5 ± 0.7 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0956 |
| Residual factor for significantly intense reflections | 0.0686 |
| Weighted residual factors for significantly intense reflections | 0.1453 |
| Weighted residual factors for all reflections included in the refinement | 0.1595 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.009 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181279 (current) | 2016-04-03 | hkl/2/23/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23/57. |
2235799.cif 2235799.hkl |
| 176435 | 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. |
2235799.cif 2235799.hkl |
| 120072 | 2014-07-11 | Adding DOIs to range 2 structures. | 2235799.cif 2235799.hkl |
| 88064 | 2013-08-29 | Adding _cod_database_fobs_code data item to all COD CIFs that have Fobs deposited and did not have this data item yet. | 2235799.cif 2235799.hkl |
| 66590 | 2012-09-11 | hkl/ Adding assigned .htl files for the most recent IUCr data depositions. |
2235799.cif 2235799.hkl |
| 65828 | 2012-09-06 | cif/ Adding structures of 2235799 via cif-deposit CGI script. |
2235799.cif |
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Users of the data should acknowledge the original authors of the
structural data.