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Information card for entry 7235090
Preview
| Coordinates | 7235090.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | catena-poly[tetrakis(mu-acetato-kO:kO')(mu-9-methyladenine-kN1:kN7)dicopper(II)].methanol (1/1) |
|---|---|
| Formula | C15 H23 Cu2 N5 O9 |
| Calculated formula | C15 H23 Cu2 N5 O9 |
| Title of publication | Providing evidence for the requirements to achieve supramolecular materials based on metal‒nucleobase entities |
| Authors of publication | Thomas-Gipson, Jintha; Beobide, Garikoitz; Castillo, Oscar; Luque, Antonio; Pascual-Colino, Jon; Pérez-Yáñez, Sonia; Román, Pascual |
| Journal of publication | CrystEngComm |
| Year of publication | 2018 |
| Journal volume | 20 |
| Journal issue | 18 |
| Pages of publication | 2528 |
| a | 7.3349 ± 0.0008 Å |
| b | 8.5513 ± 0.0008 Å |
| c | 16.8119 ± 0.0012 Å |
| α | 94.649 ± 0.007° |
| β | 93.046 ± 0.007° |
| γ | 99.041 ± 0.008° |
| Cell volume | 1035.64 ± 0.17 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1019 |
| Residual factor for significantly intense reflections | 0.0635 |
| Weighted residual factors for significantly intense reflections | 0.108 |
| Weighted residual factors for all reflections included in the refinement | 0.1231 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.083 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 227793 (current) | 2019-11-14 | cif/ Adding structures of 7235085, 7235086, 7235087, 7235088, 7235089, 7235090 via cif-deposit CGI script. |
7235090.cif |
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Users of the data should acknowledge the original authors of the
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