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Information card for entry 7022555
Preview
Coordinates | 7022555.cif |
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Original paper (by DOI) | HTML |
Formula | C142.65 H116.31 B8 Cl19.31 Co4 F32 N25 O17 S8 |
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Calculated formula | C141.655 H114.31 B8 Cl17.31 Co4 F32 N25 O17 S8 |
Title of publication | Synthesis of ligands containing N-oxide donor atoms and their assembly into metallosupramolecular structures. |
Authors of publication | Bullock, Samantha J.; Harding, Lindsay P.; Moore, Michelle P.; Mills, Andrew; Piela, Sean A. F.; Rice, Craig R.; Towns-Andrews, Liz; Whitehead, Martina |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2013 |
Journal volume | 42 |
Journal issue | 16 |
Pages of publication | 5805 - 5811 |
a | 17.9775 ± 0.0015 Å |
b | 21.8535 ± 0.0018 Å |
c | 24.415 ± 0.002 Å |
α | 105.483 ± 0.002° |
β | 95.76 ± 0.002° |
γ | 103.275 ± 0.002° |
Cell volume | 8862.2 ± 1.3 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 9 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1574 |
Residual factor for significantly intense reflections | 0.0925 |
Weighted residual factors for significantly intense reflections | 0.2724 |
Weighted residual factors for all reflections included in the refinement | 0.3036 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.071 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
179930 (current) | 2016-03-25 | cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/25. |
7022555.cif |
90282 | 2013-11-17 | cif/ Adding structures of 7022555, 7022556, 7022557, 7022558 via cif-deposit CGI script. |
7022555.cif |
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Users of the data should acknowledge the original authors of the
structural data.