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Information card for entry 7036058
Preview
Coordinates | 7036058.cif |
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Original paper (by DOI) | HTML |
Formula | C26 H19 N3 O |
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Calculated formula | C26 H19 N3 O |
SMILES | c1ccc2c(c1)cc(cc2)COc1cc(c2ccccn2)nc(c1)c1ccccn1 |
Title of publication | The effect of potential supramolecular-bond promoters on the DNA-interacting abilities of copper-terpyridine compounds. |
Authors of publication | Grau, Jordi; Brissos, Rosa F.; Salinas-Uber, Jorge; Caballero, Ana B.; Caubet, Amparo; Roubeau, Olivier; Korrodi-Gregório, Luís; Pérez-Tomás, Ricardo; Gamez, Patrick |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2015 |
Journal volume | 44 |
Journal issue | 36 |
Pages of publication | 16061 - 16072 |
a | 5.9083 ± 0.0015 Å |
b | 8.824 ± 0.002 Å |
c | 18.775 ± 0.005 Å |
α | 90° |
β | 96.643 ± 0.018° |
γ | 90° |
Cell volume | 972.3 ± 0.4 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 99.65 K |
Number of distinct elements | 4 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.1215 |
Residual factor for significantly intense reflections | 0.0963 |
Weighted residual factors for significantly intense reflections | 0.2477 |
Weighted residual factors for all reflections included in the refinement | 0.2762 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.125 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7036058.html
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