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Information card for entry 4501754
Preview
Coordinates | 4501754.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C29 H25 Ce N9 O16 |
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Calculated formula | C29 H25 Ce N9 O16 |
SMILES | C1(=O)c2cccc3[n]2[Ce]2456(O1)(OC(=O)c1cccc(C(=O)O5)[n]21)(OC(=O)c1cccc(C(=O)O6)[n]41)OC3=O.[nH+]1c(=O)[nH]ccc1N.[nH+]1c(=O)[nH]ccc1N.O.O |
Title of publication | Protonated Adenine and Cytosine Ribbons Stabilized by Dipicolinato Metal Frameworks |
Authors of publication | Das, Babulal; Baruah, Jubaraj B. |
Journal of publication | Crystal Growth & Design |
Year of publication | 2010 |
Journal volume | 10 |
Journal issue | 7 |
Pages of publication | 3242 |
a | 15.9668 ± 0.0004 Å |
b | 17.7252 ± 0.0004 Å |
c | 11.5612 ± 0.0004 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 3271.99 ± 0.16 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 5 |
Space group number | 41 |
Hermann-Mauguin space group symbol | A e a 2 |
Hall space group symbol | A 2 -2ab |
Residual factor for all reflections | 0.0406 |
Residual factor for significantly intense reflections | 0.0345 |
Weighted residual factors for significantly intense reflections | 0.0818 |
Weighted residual factors for all reflections included in the refinement | 0.0851 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.985 |
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/4501754.html
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