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Information card for entry 4500561
Preview
Coordinates | 4500561.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C26 H32 N6 |
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Calculated formula | C26 H32 N6 |
SMILES | c12c(cn(c3cc(ncn3)n3cc4c([C@@]5(CC[C@H]4C5(C)C)C)n3)n2)[C@H]2CC[C@@]1(C2(C)C)C |
Title of publication | Ag(I) and Cu(I) [2 ×2] Chiral Grids Containing Pyrimidine Ligands with Camphor Moieties. Arene Encapsulation |
Authors of publication | Carrión, M. Carmen; Ortiz, Isabel M.; Jalón, Félix A.; Manzano, Blanca R.; Rodríguez, Ana M.; Elguero, José |
Journal of publication | Crystal Growth & Design |
Year of publication | 2011 |
Journal volume | 11 |
Journal issue | 5 |
Pages of publication | 1766 |
a | 8.6671 ± 0.0006 Å |
b | 11.678 ± 0.001 Å |
c | 19.4868 ± 0.0017 Å |
α | 81.592 ± 0.004° |
β | 80.848 ± 0.004° |
γ | 68.625 ± 0.004° |
Cell volume | 1804.9 ± 0.3 Å3 |
Cell temperature | 230 ± 2 K |
Ambient diffraction temperature | 230 ± 2 K |
Number of distinct elements | 3 |
Space group number | 1 |
Hermann-Mauguin space group symbol | P 1 |
Hall space group symbol | P 1 |
Residual factor for all reflections | 0.1466 |
Residual factor for significantly intense reflections | 0.0713 |
Weighted residual factors for significantly intense reflections | 0.167 |
Weighted residual factors for all reflections included in the refinement | 0.2226 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.962 |
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/4500561.html
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Users of the data should acknowledge the original authors of the
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