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Information card for entry 2019853
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Coordinates | 2019853.cif |
---|---|
Structure factors | 2019853.hkl |
Original paper (by DOI) | HTML |
Common name | 1,1'-[Imidazolidine-1,3-diylbis(methylene)]bis(naphthalen-2-ol) |
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Chemical name | 1-({3-[(2-Hydroxynaphthalen-1-yl)methyl]imidazolidin-1-yl}methyl)naphthalen-2-ol |
Formula | C25 H24 N2 O2 |
Calculated formula | C25 H24 N2 O2 |
Title of publication | Crystal structure of 1,1′-[imidazolidine-1,3-diylbis(methylene)]bis(naphthalen-2-ol) |
Authors of publication | Rivera, Augusto; Rojas, Jicli José; Ríos-Motta, Jaime; Bolte, Michael |
Journal of publication | Acta Crystallographica Section E Crystallographic Communications |
Year of publication | 2015 |
Journal volume | 71 |
Journal issue | 3 |
Pages of publication | 258 |
a | 34.883 ± 0.005 Å |
b | 8.3956 ± 0.0009 Å |
c | 6.583 ± 0.0008 Å |
α | 90° |
β | 95.65 ± 0.011° |
γ | 90° |
Cell volume | 1918.6 ± 0.4 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 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 all reflections | 0.0686 |
Residual factor for significantly intense reflections | 0.0546 |
Weighted residual factors for significantly intense reflections | 0.1503 |
Weighted residual factors for all reflections included in the refinement | 0.1585 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.088 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
Revision | Date | Message | Files |
---|---|---|---|
181868 (current) | 2016-04-06 | hkl/2/01/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/01/98. |
2019853.cif 2019853.hkl |
180866 | 2016-04-02 | cif/2/01/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/01/98. |
2019853.cif 2019853.hkl |
176760 | 2016-02-20 | cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/01. |
2019853.cif 2019853.hkl |
131561 | 2015-02-08 | cif/ hkl/ Adding structures of 2019853 via cif-deposit CGI script. |
2019853.cif 2019853.hkl |
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Users of the data should acknowledge the original authors of the
structural data.