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Information card for entry 7017383
Preview
Coordinates | 7017383.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C43 H60 Mg N4 |
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Calculated formula | C43 H60 Mg N4 |
SMILES | [Mg]1(N(C(=CC(=[N]1c1c(cccc1C(C)C)C(C)C)C)C)c1c(cccc1C(C)C)C(C)C)(N1C=C(CC(=C1)C)C)[n]1cc(cc(c1)C)C |
Title of publication | Magnesium hydrides and the dearomatisation of pyridine and quinoline derivatives. |
Authors of publication | Hill, Michael S.; Kociok-Köhn, Gabriele; Macdougall, Dugald J.; Mahon, Mary F.; Weetman, Catherine |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2011 |
Journal volume | 40 |
Journal issue | 46 |
Pages of publication | 12500 - 12509 |
a | 10.5988 ± 0.0001 Å |
b | 18.1105 ± 0.0002 Å |
c | 21.0057 ± 0.0002 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 4032.04 ± 0.07 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 4 |
Space group number | 19 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for all reflections | 0.0426 |
Residual factor for significantly intense reflections | 0.0384 |
Weighted residual factors for significantly intense reflections | 0.098 |
Weighted residual factors for all reflections included in the refinement | 0.1014 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.055 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7017383.html
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