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Information card for entry 7045778
Preview
Coordinates | 7045778.cif |
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Original paper (by DOI) | HTML |
Chemical name | (5R,7R)-6,6-dimethyl-5,6,7,8-tetrahydro-5,7-methanoquinoline-2-carbaldehyde |
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Formula | C13 H15 N O |
Calculated formula | C13 H15 N O |
Title of publication | Versatile synthesis of chiral 6-oxoverdazyl radical ligands - new building blocks for multifunctional molecule-based magnets. |
Authors of publication | Solea, Atena B.; Wohlhauser, Tobie; Abbasi, Parisa; Mongbanziama, Yvan; Crochet, Aurelien; Fromm, Katharina M.; Novitchi, Ghenadie; Train, Cyrille; Pilkington, Melanie; Mamula, Olimpia |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2018 |
Journal volume | 47 |
Journal issue | 14 |
Pages of publication | 4785 - 4789 |
a | 6.5369 ± 0.0004 Å |
b | 7.0071 ± 0.0003 Å |
c | 12.2187 ± 0.0007 Å |
α | 90° |
β | 100.72 ± 0.005° |
γ | 90° |
Cell volume | 549.91 ± 0.05 Å3 |
Cell temperature | 200 ± 2 K |
Ambient diffraction temperature | 200 ± 2 K |
Number of distinct elements | 4 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0334 |
Residual factor for significantly intense reflections | 0.0317 |
Weighted residual factors for significantly intense reflections | 0.0875 |
Weighted residual factors for all reflections included in the refinement | 0.0891 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.062 |
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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