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Information card for entry 7035937
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Coordinates | 7035937.cif |
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Original paper (by DOI) | HTML |
Common name | phen(N-Mes)2 |
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Formula | C30 H28 N4 |
Calculated formula | C30 H28 N4 |
SMILES | N(=C1c2c(c3ncccc3C1=Nc1c(cc(cc1C)C)C)nccc2)c1c(cc(cc1C)C)C |
Title of publication | Novel phenanthroline-diaryldiazadiene ligands with heteroditopic coordination spheres. |
Authors of publication | Sorsche, Dieter; Pehlken, Christian; Baur, Christian; Rommel, Sebastian; Kastner, Katharina; Streb, Carsten; Rau, Sven |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2015 |
Journal volume | 44 |
Journal issue | 35 |
Pages of publication | 15404 - 15407 |
a | 9.4981 ± 0.0005 Å |
b | 10.2782 ± 0.0005 Å |
c | 13.8108 ± 0.0008 Å |
α | 92.571 ± 0.004° |
β | 109.723 ± 0.005° |
γ | 107.893 ± 0.005° |
Cell volume | 1191.05 ± 0.13 Å3 |
Cell temperature | 180 ± 2 K |
Ambient diffraction temperature | 180 ± 2 K |
Number of distinct elements | 3 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0471 |
Residual factor for significantly intense reflections | 0.0385 |
Weighted residual factors for significantly intense reflections | 0.1009 |
Weighted residual factors for all reflections included in the refinement | 0.1073 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.035 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7035937.html
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Users of the data should acknowledge the original authors of the
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