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Information card for entry 7027221
Preview
Coordinates | 7027221.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C47 H77 Fe4 Mo N4 S10 |
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Calculated formula | C47 H59 Fe4 Mo N4 S10 |
Title of publication | Exo-iron centres linked to MoFeS clusters |
Authors of publication | Barrière, Frédéric; Evans, David J.; Hughes, David L.; Ibrahim, Saad K.; Talarmin, Jean; Pickett, Christopher J. |
Journal of publication | Journal of the Chemical Society, Dalton Transactions |
Year of publication | 1999 |
Journal issue | 6 |
Pages of publication | 957 |
a | 12.5572 ± 0.0013 Å |
b | 13.7113 ± 0.0013 Å |
c | 19.494 ± 0.002 Å |
α | 99.835 ± 0.008° |
β | 87.427 ± 0.008° |
γ | 107.024 ± 0.008° |
Cell volume | 3162.1 ± 0.6 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 1 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 | 0.0641 |
Residual factor for significantly intense reflections | 0.0413 |
Weighted residual factors for all reflections | 0.1179 |
Weighted residual factors for significantly intense reflections | 0.1013 |
Goodness-of-fit parameter for all reflections | 1.072 |
Goodness-of-fit parameter for significantly intense reflections | 1.107 |
Diffraction radiation wavelength | 0.71069 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/7027221.html
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Users of the data should acknowledge the original authors of the
structural data.