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Information card for entry 7005428
Preview
Coordinates | 7005428.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C6 H22 F8 N4 O2 V2 |
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Calculated formula | C6 H22 F8 N4 O2 V2 |
SMILES | C(C[NH2+]CC[NH2+]CC[NH3+])[NH3+].F[V]1(F)(=O)(F)[F][V](F)([F]1)(F)(F)=O |
Title of publication | Hydrothermal chemistry of oligomeric vanadium oxyfluorides. |
Authors of publication | Aldous, David W.; Stephens, Nicholas F.; Lightfoot, Philip |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2007 |
Journal issue | 22 |
Pages of publication | 2271 - 2282 |
a | 7.9286 ± 0.0019 Å |
b | 10.591 ± 0.003 Å |
c | 8.497 ± 0.002 Å |
α | 90° |
β | 97.834 ± 0.006° |
γ | 90° |
Cell volume | 706.8 ± 0.3 Å3 |
Cell temperature | 93 ± 2 K |
Ambient diffraction temperature | 93 ± 2 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0535 |
Residual factor for significantly intense reflections | 0.0418 |
Weighted residual factors for significantly intense reflections | 0.1325 |
Weighted residual factors for all reflections included in the refinement | 0.173 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.602 |
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/7005428.html
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Users of the data should acknowledge the original authors of the
structural data.