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Information card for entry 7036991
Preview
Coordinates | 7036991.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C21 H18 Cl5 Mn N2 O3 |
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Calculated formula | C21 H18 Cl5 Mn N2 O3 |
SMILES | [Mn]123(Cl)(Oc4c(Cl)cc(Cl)cc4C[N]2(Cc2c(O1)c(Cl)cc(Cl)c2)Cc1[n]3cccc1)[OH]C |
Title of publication | Exploring the reactivity of manganese(iii) complexes with diphenolate-diamino ligands in rac-lactide polymerization. |
Authors of publication | Daneshmand, Pargol; Schaper, Frank |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2015 |
Journal volume | 44 |
Journal issue | 47 |
Pages of publication | 20449 - 20458 |
a | 12.7413 ± 0.0007 Å |
b | 13.0938 ± 0.0007 Å |
c | 16.8087 ± 0.0009 Å |
α | 90° |
β | 100.589 ± 0.002° |
γ | 90° |
Cell volume | 2756.5 ± 0.3 Å3 |
Cell temperature | 100 K |
Ambient diffraction temperature | 100 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0436 |
Residual factor for significantly intense reflections | 0.0394 |
Weighted residual factors for significantly intense reflections | 0.1069 |
Weighted residual factors for all reflections included in the refinement | 0.1116 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.043 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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