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Information card for entry 7027035
Preview
Coordinates | 7027035.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C15 H6 Fe3 O8 Se |
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Calculated formula | C15 H6 Fe3 O8 Se |
SMILES | [Se]12[Fe]3([Fe]41([Fe]15678([C]9(C2)=[CH]1[CH]5=[CH]6[CH]7=[C]3489)(C#[O])C#[O])(C#[O])(C#[O])C#[O])(C#[O])(C#[O])C#[O] |
Title of publication | The reactions of heterocyclic organotellurium and selenium compounds with triiron dodecacarbonyl |
Authors of publication | Majeed, Zulfiqar; McWhinnie, William R.; Paxton, Keith; Hamor, Thomas A. |
Journal of publication | Journal of the Chemical Society, Dalton Transactions |
Year of publication | 1998 |
Journal issue | 23 |
Pages of publication | 3947 |
a | 8.264 ± 0.001 Å |
b | 15.591 ± 0.002 Å |
c | 13.628 ± 0.002 Å |
α | 90° |
β | 97.34 ± 0.01° |
γ | 90° |
Cell volume | 1741.5 ± 0.4 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
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 | 0.0401 |
Residual factor for significantly intense reflections | 0.0366 |
Weighted residual factors for all reflections | 0.1009 |
Weighted residual factors for significantly intense reflections | 0.0985 |
Goodness-of-fit parameter for all reflections | 1.166 |
Goodness-of-fit parameter for significantly intense reflections | 1.175 |
Diffraction radiation wavelength | 0.7107 Å |
Diffraction radiation type | MoKa |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7027035.html
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