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Information card for entry 7206138
Preview
Coordinates | 7206138.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C24 H14 F8 I6 N2 |
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Calculated formula | C24 H14 F8 I6 N2 |
SMILES | c1cc(c2cc[n+](cc2)Cc2c(c(F)cc(F)c2F)F)cc[n+]1Cc1c(c(F)cc(c1F)F)F.I[I-]I.I[I-]I |
Title of publication | Dimensional caging of polyiodides: cation-templated synthesis using bipyridinium salts |
Authors of publication | García, Marcos D.; Martí-Rujas, Javier; Metrangolo, Pierangelo; Peinador, Carlos; Pilati, Tullio; Resnati, Giuseppe; Terraneo, Giancarlo; Ursini, Maurizio |
Journal of publication | CrystEngComm |
Year of publication | 2011 |
Journal volume | 13 |
Journal issue | 13 |
Pages of publication | 4411 |
a | 7.6088 ± 0.0005 Å |
b | 7.697 ± 0.0005 Å |
c | 14.1513 ± 0.0009 Å |
α | 99.02 ± 0.003° |
β | 93.382 ± 0.003° |
γ | 105.947 ± 0.003° |
Cell volume | 782.46 ± 0.09 Å3 |
Cell temperature | 297 ± 2 K |
Ambient diffraction temperature | 297 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0869 |
Residual factor for significantly intense reflections | 0.0312 |
Weighted residual factors for significantly intense reflections | 0.0679 |
Weighted residual factors for all reflections included in the refinement | 0.0814 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.866 |
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/7206138.html
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Users of the data should acknowledge the original authors of the
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