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Information card for entry 1515348
Preview
Coordinates | 1515348.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C38 H60 F6 N4 O6 S2 |
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Calculated formula | C38 H60 F6 N4 O6 S2 |
SMILES | S(=O)(=O)([O-])C(F)(F)F.S(=O)(=O)([O-])C(F)(F)F.n1(c[n+](cc1)c1ccc([n+]2cn(cc2)CCCCCCCCCCCC)cc1)CCCCCCCCCCCC |
Title of publication | Mesomorphic and ion conducting properties of dialkyl(1,4-phenylene)diimidazolium salts |
Authors of publication | Noujeim, Nadim; Samsam, Salim; Eberlin, Ludovic; Sanon, Samantha H.; Rochefort, Dominic; Schmitzer, Andreea R. |
Journal of publication | Soft Matter |
Year of publication | 2012 |
Journal volume | 8 |
Journal issue | 42 |
Pages of publication | 10914 |
a | 8.4599 ± 0.0002 Å |
b | 8.5465 ± 0.0002 Å |
c | 16.5655 ± 0.0004 Å |
α | 81.9423 ± 0.0011° |
β | 76.9685 ± 0.0011° |
γ | 72.9996 ± 0.001° |
Cell volume | 1112.34 ± 0.05 Å3 |
Cell temperature | 150 K |
Ambient diffraction temperature | 150 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0443 |
Residual factor for significantly intense reflections | 0.043 |
Weighted residual factors for significantly intense reflections | 0.1151 |
Weighted residual factors for all reflections included in the refinement | 0.1163 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.031 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/1515348.html
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Users of the data should acknowledge the original authors of the
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