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Information card for entry 2221240
Preview
Coordinates | 2221240.cif |
---|---|
Structure factors | 2221240.hkl |
Original IUCr paper | HTML |
Common name | 6,6'-Dimethoxy-2,2'-[<i>p</i>-phenylenebis(nitrilomethylidyne)]diphenol chloroform disolvates |
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Chemical name | 6,6'-Dimethoxy-2,2'-[<i>p</i>-phenylenebis(nitrilomethylidyne)]diphenol chloroform disolvates |
Formula | C24 H22 Cl6 N2 O4 |
Calculated formula | C24 H22 Cl6 N2 O4 |
SMILES | ClC(Cl)Cl.ClC(Cl)Cl.COc1cccc(c1O)/C=N/c1ccc(cc1)/N=C/c1cccc(c1O)OC |
Title of publication | 6,6'-Dimethoxy-2,2'-[<i>p</i>-phenylenebis(nitrilomethylidyne)]diphenol chloroform disolvate |
Authors of publication | Al-Douh, Mohammed H.; Osman, Hasnah; Hamid, Shafida Abd.; Kia, Reza; Fun, Hoong-Kun |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2009 |
Journal volume | 65 |
Journal issue | 4 |
Pages of publication | o680 - o681 |
a | 10.4773 ± 0.0002 Å |
b | 21.3287 ± 0.0005 Å |
c | 6.2424 ± 0.0002 Å |
α | 90° |
β | 105.669 ± 0.002° |
γ | 90° |
Cell volume | 1343.13 ± 0.06 Å3 |
Cell temperature | 100 K |
Ambient diffraction temperature | 100 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0565 |
Residual factor for significantly intense reflections | 0.0361 |
Weighted residual factors for significantly intense reflections | 0.0802 |
Weighted residual factors for all reflections included in the refinement | 0.0896 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.033 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
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The link is: https://www.crystallography.net/2221240.html
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