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Information card for entry 4301803
Preview
Coordinates | 4301803.cif |
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Original paper (by DOI) | HTML |
Formula | C46 H32 Fe N6 O P |
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Calculated formula | C46 H32 Fe N6 O P |
SMILES | [Fe]12(C#N)(C#N)(C#N)[n]3cccc4cccc(c34)N1C(=O)c1ccc3ccccc3[n]21.[P+](c1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1 |
Title of publication | Cyanide-Bridged FeIII-MnIII Bimetallic Complexes with Dimeric and Chain Structures Constructed from a Newly Mademer-Fe Tricyanide: Structures and Magnetic Properties |
Authors of publication | Jae Il Kim; Hyun Young Kwak; Jung Hee Yoon; Dae Won Ryu; In Young Yoo; Namgeun Yang; Beong Ki Cho; Je-Geun Park; Hyosug Lee; Chang Seop Hong |
Journal of publication | Inorganic Chemistry |
Year of publication | 2009 |
Journal volume | 48 |
Pages of publication | 2956 - 2966 |
a | 9.3047 ± 0.0004 Å |
b | 14.7946 ± 0.0007 Å |
c | 14.8284 ± 0.0007 Å |
α | 109.413 ± 0.001° |
β | 97.306 ± 0.002° |
γ | 100.32 ± 0.002° |
Cell volume | 1855.33 ± 0.15 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 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 | 0.1486 |
Residual factor for significantly intense reflections | 0.104 |
Weighted residual factors for significantly intense reflections | 0.2168 |
Weighted residual factors for all reflections included in the refinement | 0.2432 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.043 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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