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Information card for entry 7028809
Preview
Coordinates | 7028809.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C14 H34 Cu Mo8 N8 O34 |
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Calculated formula | C14 H28 Cu Mo8 N8 O34 |
SMILES | c12c[nH+]cc[n]1[Cu]1([n]3c(C(=O)O1)c[nH+]cc3)OC2=O.C(C[NH3+])[NH3+].[Mo]1234(O[Mo]56(=O)(O[Mo]78([O]1[Mo]19(=O)(O[Mo]%10%11(O[Mo]%12%13([O]%14[Mo]([O]267[Mo]%14(=O)(O5)([O]4%12)=O)([O]31%10%13)([O]89)(=O)O%11)(=O)=O)(=O)=O)=O)(=O)=O)=O)=O.O.O.C(C[NH3+])[NH3+].O.O |
Title of publication | pH and amine-induced various octamolybdate-based metal-organic complexes: assembly, structures and properties. |
Authors of publication | Wang, Xiuli; Han, Na; Lin, Hongyan; Tian, Aixiang; Liu, Guocheng; Zhang, Juwen |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2014 |
Journal volume | 43 |
Journal issue | 5 |
Pages of publication | 2052 - 2060 |
a | 8.4443 ± 0.0005 Å |
b | 10.7103 ± 0.0007 Å |
c | 11.8338 ± 0.0008 Å |
α | 71.646 ± 0.001° |
β | 84.246 ± 0.001° |
γ | 81.5 ± 0.001° |
Cell volume | 1003.01 ± 0.11 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0253 |
Residual factor for significantly intense reflections | 0.0237 |
Weighted residual factors for significantly intense reflections | 0.0649 |
Weighted residual factors for all reflections included in the refinement | 0.0659 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.022 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7028809.html
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Users of the data should acknowledge the original authors of the
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