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Information card for entry 7207931
Preview
Coordinates | 7207931.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C44 H44 O10 |
---|---|
Calculated formula | C44 H44 O10 |
SMILES | c1(ccccc1)C1=C([C@@]2(c3c1c(c(c(c3)OC)OC)OC)CCC1=C([C@H](c3ccccc3)c3c(c(c(c2c13)OC)OC)OC)C(=O)OCC)C(=O)OCC.c1(ccccc1)C1=C([C@]2(c3c1c(c(c(c3)OC)OC)OC)CCC1=C([C@@H](c3ccccc3)c3c(c(c(c2c13)OC)OC)OC)C(=O)OCC)C(=O)OCC |
Title of publication | Synthesis and characterization of charge-transporting π-stacked polybenzofulvene derivatives |
Authors of publication | Cappelli, Andrea; Paolino, Marco; Grisci, Giorgio; Giuliani, Germano; Donati, Alessandro; Mendichi, Raniero; Boccia, Antonella Caterina; Botta, Chiara; Mróz, Wojciech; Samperi, Filippo; Scamporrino, Andrea; Giorgi, Gianluca; Vomero, Salvatore |
Journal of publication | Journal of Materials Chemistry |
Year of publication | 2012 |
Journal volume | 22 |
Journal issue | 19 |
Pages of publication | 9611 |
a | 19.246 ± 0.003 Å |
b | 23.211 ± 0.005 Å |
c | 17.018 ± 0.002 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 7602 ± 2 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 3 |
Space group number | 60 |
Hermann-Mauguin space group symbol | P n c a |
Hall space group symbol | -P 2a 2n |
Residual factor for all reflections | 0.3901 |
Residual factor for significantly intense reflections | 0.0552 |
Weighted residual factors for significantly intense reflections | 0.0664 |
Weighted residual factors for all reflections included in the refinement | 0.1096 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.652 |
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/7207931.html
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Users of the data should acknowledge the original authors of the
structural data.