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Information card for entry 7035861
Preview
Coordinates | 7035861.cif |
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Original paper (by DOI) | HTML |
Formula | C34 H32 N2 O8 |
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Calculated formula | C34 H32 N2 O8 |
SMILES | OC(=O)c1ccc(cc1)CN(Cc1ccc(cc1)C(=O)O)CCN(Cc1ccc(cc1)C(=O)O)Cc1ccc(cc1)C(=O)O |
Title of publication | Coordination polymers from a highly flexible alkyldiamine-derived ligand: structure, magnetism and gas adsorption studies. |
Authors of publication | Hawes, Chris S.; Chilton, Nicholas F.; Moubaraki, Boujemaa; Knowles, Gregory P.; Chaffee, Alan L.; Murray, Keith S.; Batten, Stuart R.; Turner, David R. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2015 |
Journal volume | 44 |
Journal issue | 40 |
Pages of publication | 17494 - 17507 |
a | 6.888 ± 0.0014 Å |
b | 9.516 ± 0.0019 Å |
c | 22.333 ± 0.005 Å |
α | 91.24 ± 0.03° |
β | 94.48 ± 0.03° |
γ | 94.64 ± 0.03° |
Cell volume | 1454 ± 0.5 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0605 |
Residual factor for significantly intense reflections | 0.0507 |
Weighted residual factors for significantly intense reflections | 0.1344 |
Weighted residual factors for all reflections included in the refinement | 0.1421 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.035 |
Diffraction radiation wavelength | 0.7109 Å |
Diffraction radiation type | Synchrotron |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7035861.html
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