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Information card for entry 4312841
Preview
Coordinates | 4312841.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C36 H44 N14 Ru2 |
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Calculated formula | C36 H44 N14 Ru2 |
SMILES | C1(c2ccccc2)=[N](C)[Ru]234([Ru](N=N#N)(N1C)([N](=C(c1ccccc1)N3C)C)(N(C(c1ccccc1)=[N]4C)C)[N](=C(c1ccccc1)N2C)C)N=N#N |
Title of publication | Synthesis and Characterization of Ru2(DMBA)4X2 (X = CN, N3, N(CN)2, I): Controlling Structural, Redox, and Magnetic Properties with Axial Ligands |
Authors of publication | Wei-Zhong Chen; Tong Ren |
Journal of publication | Inorganic Chemistry |
Year of publication | 2003 |
Journal volume | 42 |
Pages of publication | 8847 - 8852 |
a | 12.255 ± 0.002 Å |
b | 21.136 ± 0.003 Å |
c | 15.549 ± 0.003 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 4027.5 ± 1.2 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 300 ± 2 K |
Number of distinct elements | 4 |
Space group number | 60 |
Hermann-Mauguin space group symbol | P b c n |
Hall space group symbol | -P 2n 2ab |
Residual factor for all reflections | 0.0575 |
Residual factor for significantly intense reflections | 0.0384 |
Weighted residual factors for significantly intense reflections | 0.0966 |
Weighted residual factors for all reflections included in the refinement | 0.1017 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.001 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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