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Information card for entry 3500035
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Coordinates | 3500035.cif |
---|---|
Structure factors | 3500035.hkl |
Formula | C17 H22 Cl2 Cu N4 O9 |
---|---|
Calculated formula | C17 H22 Cl2 Cu N4 O9 |
Authors of publication | Juergen Lange |
Journal of publication | Personal communication to COD |
Year of publication | 2016 |
a | 8.812 ± 0.003 Å |
b | 11.308 ± 0.004 Å |
c | 23.127 ± 0.007 Å |
α | 90° |
β | 95.91 ± 0.02° |
γ | 90° |
Cell volume | 2292.3 ± 1.3 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298 ± 2 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0545 |
Residual factor for significantly intense reflections | 0.045 |
Weighted residual factors for all reflections | 0.1504 |
Weighted residual factors for significantly intense reflections | 0.1348 |
Goodness-of-fit parameter for all reflections | 1.084 |
Goodness-of-fit parameter for significantly intense reflections | 1.087 |
Diffraction radiation wavelength | 0.71069 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
Revision | Date | Message | Files |
---|---|---|---|
183201 (current) | 2016-06-01 | cif/ hkl/ Adding structures of 3500035 via cif-deposit CGI script. |
3500035.cif 3500035.hkl |
All data in the COD and the database itself are dedicated to the
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.
Users of the data should acknowledge the original authors of the
structural data.