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Information card for entry 4325831
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Coordinates | 4325831.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C49 H36 Fe N6 S6 |
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Calculated formula | C49 H36 Fe N6 S6 |
Title of publication | π-Extended and Six-Coordinate Iron(II) Complexes: Structures, Magnetic Properties, and the Electrochemical Synthesis of a Conducting Iron(II) Metallopolymer |
Authors of publication | Brandon Djukic; Takele Seda; Serge I. Gorelsky; Alan J. Lough; Martin T. Lemaire |
Journal of publication | Inorganic Chemistry |
Year of publication | 2011 |
Journal volume | 50 |
Pages of publication | 7334 - 7343 |
a | 10.1613 ± 0.0005 Å |
b | 15.1701 ± 0.0009 Å |
c | 16.5684 ± 0.001 Å |
α | 102.549 ± 0.003° |
β | 91.113 ± 0.004° |
γ | 106.291 ± 0.003° |
Cell volume | 2384.1 ± 0.2 Å3 |
Cell temperature | 150 ± 1 K |
Ambient diffraction temperature | 150 ± 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 | 0.143 |
Residual factor for significantly intense reflections | 0.0706 |
Weighted residual factors for significantly intense reflections | 0.1639 |
Weighted residual factors for all reflections included in the refinement | 0.1906 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.989 |
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/4325831.html
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