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Information card for entry 4339937
Preview
Coordinates | 4339937.cif |
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Original paper (by DOI) | HTML |
Formula | C32 H30 Co O6 |
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Calculated formula | C32 H30 Co O6 |
SMILES | C1(=CC(=[O][Co]2(O1)([O]=C(C=C(O2)c1ccccc1)c1ccccc1)([OH]C)[OH]C)c1ccccc1)c1ccccc1 |
Title of publication | Preparation and structure of three solvatomorphs of the polymer [Co(dbm)2(4ptz)]n: spin canting depending on the supramolecular organization. |
Authors of publication | Barrios, Leoní A; Ribas, Joan; Aromí, Guillem; Ribas-Ariño, Jordi; Gamez, Patrick; Roubeau, Olivier; Teat, Simon J. |
Journal of publication | Inorganic chemistry |
Year of publication | 2007 |
Journal volume | 46 |
Journal issue | 17 |
Pages of publication | 7154 - 7162 |
a | 16.9583 ± 0.0008 Å |
b | 16.346 ± 0.0007 Å |
c | 10.388 ± 0.0006 Å |
α | 90° |
β | 108.779 ± 0.002° |
γ | 90° |
Cell volume | 2726.3 ± 0.2 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 4 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0667 |
Residual factor for significantly intense reflections | 0.041 |
Weighted residual factors for significantly intense reflections | 0.0988 |
Weighted residual factors for all reflections included in the refinement | 0.1107 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.993 |
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/4339937.html
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