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Information card for entry 1529406
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Coordinates | 1529406.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | N-cetyl-N,N-di(2-hydroxyethyl)methylammonium bromide |
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Formula | C21 H46 Br N O2 |
Calculated formula | C21 H46 Br N O2 |
SMILES | [Br-].[N+](CCO)(CCCCCCCCCCCCCCCC)(CCO)C |
Title of publication | The role of hydroxyethyl groups in the construction of wormlike micelles in the system of quaternary ammonium surfactant and sodium salicylate. |
Authors of publication | Dai, Caili; Wu, Xuepeng; Li, Weitao; You, Qin; Zhao, Mingwei; Du, Mingyong; Liu, Yifei; Li, Yuyang |
Journal of publication | Soft matter |
Year of publication | 2015 |
Journal volume | 11 |
Journal issue | 39 |
Pages of publication | 7817 - 7826 |
a | 22.8075 ± 0.0016 Å |
b | 7.3222 ± 0.0006 Å |
c | 14.4685 ± 0.0007 Å |
α | 90° |
β | 94.765 ± 0.006° |
γ | 90° |
Cell volume | 2407.9 ± 0.3 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 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 | 0.1114 |
Residual factor for significantly intense reflections | 0.0621 |
Weighted residual factors for significantly intense reflections | 0.1738 |
Weighted residual factors for all reflections included in the refinement | 0.2553 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.288 |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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