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Information card for entry 7219640
Preview
| Coordinates | 7219640.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | 4-aminoquinaldine form II |
|---|---|
| Chemical name | 2-methyl-4-amino-quinoline form II |
| Formula | C10.08 H10 Cl0.33 N2 |
| Calculated formula | C10.0833 H10 Cl0.3334 N2 |
| Title of publication | Solid state forms of 4-aminoquinaldine - From void structures with and without solvent inclusion to close packing. |
| Authors of publication | Braun, Doris E.; Gelbrich, Thomas; Kahlenberg, Volker; Griesser, Ulrich J. |
| Journal of publication | CrystEngComm / RSC |
| Year of publication | 2015 |
| Journal volume | 17 |
| Journal issue | 12 |
| Pages of publication | 2504 - 2516 |
| a | 28.4074 ± 0.0008 Å |
| b | 28.4074 ± 0.0008 Å |
| c | 11.9126 ± 0.0005 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 8325.3 ± 0.5 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 148 |
| Hermann-Mauguin space group symbol | R -3 :H |
| Hall space group symbol | -R 3 |
| Residual factor for all reflections | 0.0673 |
| Residual factor for significantly intense reflections | 0.0564 |
| Weighted residual factors for significantly intense reflections | 0.1538 |
| Weighted residual factors for all reflections included in the refinement | 0.1637 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.012 |
| 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 |
|---|---|---|---|
| 180527 (current) | 2016-03-26 | cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/96. |
7219640.cif |
| 173761 | 2016-01-09 | cif/ Updating files of 7219639, 7219640 Original log message: Adding full bibliography for 7219639--7219640.cif. |
7219640.cif |
| 134919 | 2015-04-06 | cif/ Updating files of 7219639, 7219640 Original log message: Adding full bibliography for 7219639--7219640.cif. |
7219640.cif |
| 132397 | 2015-02-25 | cif/ Adding structures of 7219639, 7219640 via cif-deposit CGI script. |
7219640.cif |
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Users of the data should acknowledge the original authors of the
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