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Information card for entry 7212725
Preview
Coordinates | 7212725.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C60 H78 Cu2 N24 O19 S6 |
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Calculated formula | C60 H76 Cu2 N24 O19 S6 |
Title of publication | Proficiency of the electron-deficient 1,3,5-triazine ring to generate anion‒π and lone pair‒π interactions |
Authors of publication | Costa, José Sánchez; Castro, Adriana Gonzalez; Pievo, Roberta; Roubeau, Olivier; Modec, Barbara; Kozlevčar, Bojan; Teat, Simon J.; Gamez, Patrick; Reedijk, Jan |
Journal of publication | CrystEngComm |
Year of publication | 2010 |
Journal volume | 12 |
Journal issue | 10 |
Pages of publication | 3057 |
a | 27.4547 ± 0.0019 Å |
b | 11.8188 ± 0.0007 Å |
c | 25.088 ± 0.002 Å |
α | 90° |
β | 103.849 ± 0.002° |
γ | 90° |
Cell volume | 7903.9 ± 1 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 6 |
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 | 0.1051 |
Residual factor for significantly intense reflections | 0.0588 |
Weighted residual factors for significantly intense reflections | 0.1637 |
Weighted residual factors for all reflections included in the refinement | 0.184 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.965 |
Diffraction radiation wavelength | 0.6911 Å |
Diffraction radiation type | synchrotron |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7212725.html
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