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Information card for entry 7203641
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Coordinates | 7203641.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C25 H38 Cu N4 O14 |
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Calculated formula | C25 H32 Cu N4 O14 |
Title of publication | A molecular ?back-flip?: the structural consequences of the crystal-to-crystal phase transition between [(phen)2CuCO3]?11H2O and [(phen)2CuCO3]?7H2O |
Authors of publication | Doyle, Robert P.; Nieuwenhuyzen, Mark; Kruger, Paul E. |
Journal of publication | CrystEngComm |
Year of publication | 2006 |
Journal volume | 8 |
Journal issue | 12 |
Pages of publication | 904 |
a | 10.873 ± 0.002 Å |
b | 11.598 ± 0.002 Å |
c | 13.394 ± 0.003 Å |
α | 77.732 ± 0.009° |
β | 77.628 ± 0.005° |
γ | 70.025 ± 0.005° |
Cell volume | 1532.6 ± 0.5 Å3 |
Cell temperature | 153 ± 2 K |
Ambient diffraction temperature | 153 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0919 |
Residual factor for significantly intense reflections | 0.0625 |
Weighted residual factors for significantly intense reflections | 0.1659 |
Weighted residual factors for all reflections included in the refinement | 0.1844 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.069 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7203641.html
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structural data.