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Information card for entry 7028409
Preview
Coordinates | 7028409.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C77 H65 Mo N2 O11 P7 |
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Calculated formula | C77 H65 Mo N2 O11 P7 |
SMILES | [Mo]1234(OP5(=O)OP(=O)(OP(=O)(O5)O1)O2)(C#[O])(C#[O])[CH](=[CH2]3)C4.P(c1ccccc1)(c1ccccc1)(=N[P+](c1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1.P(c1ccccc1)(=N[P+](c1ccccc1)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1 |
Title of publication | Facile synthesis of mononuclear early transition-metal complexes of κ3cyclo-tetrametaphosphate ([P4O12]4-) and cyclo-trimetaphosphate ([P3O9]3-. |
Authors of publication | Manna, Cesar M.; Nassar, Mostafa Y.; Tofan, Daniel; Chakarawet, Khetpakorn; Cummins, Christopher C. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2014 |
Journal volume | 43 |
Journal issue | 4 |
Pages of publication | 1509 - 1518 |
a | 29.871 ± 0.005 Å |
b | 13.004 ± 0.002 Å |
c | 20.9 ± 0.003 Å |
α | 90° |
β | 122.557 ± 0.002° |
γ | 90° |
Cell volume | 6842.7 ± 1.8 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 6 |
Space group number | 9 |
Hermann-Mauguin space group symbol | C 1 c 1 |
Hall space group symbol | C -2yc |
Residual factor for all reflections | 0.0237 |
Residual factor for significantly intense reflections | 0.0225 |
Weighted residual factors for significantly intense reflections | 0.0588 |
Weighted residual factors for all reflections included in the refinement | 0.0598 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.041 |
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/7028409.html
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Users of the data should acknowledge the original authors of the
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