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Information card for entry 7000047
Preview
Coordinates | 7000047.cif |
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Original paper (by DOI) | HTML |
Formula | C35 H32 B Mn N4 O3 S2 |
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Calculated formula | C35 H32 B Mn N4 O3 S2 |
Title of publication | Manganese(I) poly(mercaptoimidazolyl)borate complexes: spectroscopic and structural characterization of Mn...H-B interactions in solution and in the solid state. |
Authors of publication | Graham, Leigh A.; Fout, Alison R.; Kuehne, Karl R.; White, Jennifer L.; Mookherji, Bhaskar; Marks, Fred M.; Yap, Glenn P. A.; Zakharov, Lev N.; Rheingold, Arnold L.; Rabinovich, Daniel |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2005 |
Journal issue | 1 |
Pages of publication | 171 - 180 |
a | 9.7388 ± 0.0014 Å |
b | 12.9984 ± 0.0018 Å |
c | 14.648 ± 0.002 Å |
α | 69.777 ± 0.002° |
β | 82.398 ± 0.002° |
γ | 78.822 ± 0.002° |
Cell volume | 1702.7 ± 0.4 Å3 |
Cell temperature | 170 ± 2 K |
Ambient diffraction temperature | 443 ± 2 K |
Number of distinct elements | 7 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0379 |
Residual factor for significantly intense reflections | 0.0321 |
Weighted residual factors for significantly intense reflections | 0.0879 |
Weighted residual factors for all reflections included in the refinement | 0.0909 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.04 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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