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Information card for entry 7014565
Preview
Coordinates | 7014565.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C36 H24 F12 O10 Ru2 |
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Calculated formula | C36 H24 F12 O10 Ru2 |
SMILES | C1(c2c(F)cc(c(c2)F)F)=[O][Ru]234([O]=C(c5c(F)cc(F)c(F)c5)O[Ru]4(O1)([O]=C(c1c(cc(c(c1)F)F)F)O2)([O]=C(c1c(F)cc(F)c(F)c1)O3)[O]1CCCC1)[O]1CCCC1 |
Title of publication | Tuning of the ionization potential of paddlewheel diruthenium(II, II) complexes with fluorine atoms on the benzoate ligands. |
Authors of publication | Miyasaka, Hitoshi; Motokawa, Natsuko; Atsuumi, Ryo; Kamo, Hiromichi; Asai, Yuichiro; Yamashita, Masahiro |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2011 |
Journal volume | 40 |
Journal issue | 3 |
Pages of publication | 673 - 682 |
a | 9.2572 ± 0.0016 Å |
b | 19.413 ± 0.003 Å |
c | 10.1835 ± 0.0017 Å |
α | 90° |
β | 103.33 ± 0.002° |
γ | 90° |
Cell volume | 1780.8 ± 0.5 Å3 |
Cell temperature | 93.1 K |
Ambient diffraction temperature | 93.1 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for significantly intense reflections | 0.0471 |
Weighted residual factors for all reflections included in the refinement | 0.113 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.123 |
Diffraction radiation wavelength | 0.7107 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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