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Information card for entry 7038687
Preview
Coordinates | 7038687.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | (E)-1,2-bis(4-bromopyridin-2-yl)diazene |
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Formula | C10 H6 Br2 N4 |
Calculated formula | C10 H6 Br2 N4 |
SMILES | c1cc(cc(n1)/N=N/c1cc(ccn1)Br)Br |
Title of publication | Red-light activated photoCORMs of Mn(i) species bearing electron deficient 2,2'-azopyridines. |
Authors of publication | Kottelat, E.; Ruggi, A.; Zobi, F. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2016 |
Journal volume | 45 |
Journal issue | 16 |
Pages of publication | 6920 - 6927 |
a | 3.9747 ± 0.0003 Å |
b | 9.2426 ± 0.0011 Å |
c | 14.931 ± 0.0014 Å |
α | 90° |
β | 95.821 ± 0.007° |
γ | 90° |
Cell volume | 545.69 ± 0.09 Å3 |
Cell temperature | 300 ± 2 K |
Ambient diffraction temperature | 300 ± 2 K |
Number of distinct elements | 4 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0401 |
Residual factor for significantly intense reflections | 0.0322 |
Weighted residual factors for significantly intense reflections | 0.0708 |
Weighted residual factors for all reflections included in the refinement | 0.0732 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.118 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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