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Information card for entry 7243709
Preview
Coordinates | 7243709.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | 1,10-phenanthrolinium pamoate THF solvate |
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Formula | C39 H32 N2 O7 |
Calculated formula | C39 H32 N2 O7 |
Title of publication | Selectivity of hosts for guests by liquid-assisted grinding: differences between solution and mechanochemistry |
Authors of publication | Lombard, Jean; Laker, Heinrich; Prins, Francis; Wahl, Helene; le Roex, Tanya; Haynes, Delia A. |
Journal of publication | CrystEngComm |
Year of publication | 2021 |
Journal volume | 23 |
Journal issue | 42 |
Pages of publication | 7380 - 7384 |
a | 10.653 ± 0.003 Å |
b | 11.153 ± 0.003 Å |
c | 13.566 ± 0.004 Å |
α | 85.062 ± 0.004° |
β | 74.512 ± 0.003° |
γ | 72.396 ± 0.003° |
Cell volume | 1480.5 ± 0.7 Å3 |
Cell temperature | 108 ± 2 K |
Ambient diffraction temperature | 108 ± 2 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0966 |
Residual factor for significantly intense reflections | 0.0681 |
Weighted residual factors for significantly intense reflections | 0.1946 |
Weighted residual factors for all reflections included in the refinement | 0.2175 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.071 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
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/7243709.html
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Users of the data should acknowledge the original authors of the
structural data.