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Information card for entry 1501640
Preview
Coordinates | 1501640.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C26 H18 Br4 Cl2 N4 |
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Calculated formula | C26 H18 Br4 Cl2 N4 |
Title of publication | Molecular Tectonics. Use of Br...aryl Supramolecular Interactions for the construction of Organized Networks from 9,9'-spirobifluorene in the Crystalline State. |
Authors of publication | Ulrich Darbost; Janie Cabana; Eric Demers; Thierry Maris; James D. Wuest |
Journal of publication | CheM |
Year of publication | 2011 |
Journal volume | 1 |
Pages of publication | 52 - 12369 |
a | 17.865 ± 0.003 Å |
b | 19.788 ± 0.003 Å |
c | 16.886 ± 0.005 Å |
α | 90° |
β | 112.641 ± 0.018° |
γ | 90° |
Cell volume | 5509 ± 2 Å3 |
Cell temperature | 295 ± 2 K |
Ambient diffraction temperature | 295 ± 2 K |
Number of distinct elements | 5 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0717 |
Residual factor for significantly intense reflections | 0.0653 |
Weighted residual factors for significantly intense reflections | 0.1925 |
Weighted residual factors for all reflections included in the refinement | 0.2004 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.082 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
176729 (current) | 2016-02-18 | cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1. |
1501640.cif |
111524 | 2014-04-24 | cif/1/50/ (saulius@koala.ibt.lt) Adding DOI 10.5618/chem.2011.v1.n1.7 to the relevant structures. |
1501640.cif |
35911 | 2012-02-28 | cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree. |
1501640.cif |
28753 | 2011-11-01 | ../uploads/cif-deposit/cod/cif Adding structures of 1501635, 1501636, 1501637, 1501638, 1501639, 1501640 via cif-deposit CGI script. |
1501640.cif |
All data in the COD and the database itself are dedicated to the
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Users of the data should acknowledge the original authors of the
structural data.