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Information card for entry 4088619
Preview
Coordinates | 4088619.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C22 H24 N4 O |
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Calculated formula | C22 H24 N4 O |
SMILES | O=C(/N=C(NC12CC3CC(C1)CC(C2)C3)/c1ncccc1)c1ncccc1 |
Title of publication | Catalytically Active N-Acylamidine‒Zirconium Complexes: Synthesis, Structures, and Application in Ethylene Polymerization |
Authors of publication | Holtrichter-Rößmann, Thorsten; Häger, Ina; Daniliuc, Constantin-Gabriel; Fröhlich, Roland; Bergander, Klaus; Troll, Carsten; Rieger, Bernhard; Rojas, René S.; Würthwein, Ernst-Ulrich |
Journal of publication | Organometallics |
Year of publication | 2016 |
Journal volume | 35 |
Journal issue | 11 |
Pages of publication | 1906 |
a | 18.6586 ± 0.0005 Å |
b | 18.6586 ± 0.0005 Å |
c | 11.1468 ± 0.0002 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 3880.68 ± 0.16 Å3 |
Cell temperature | 223 ± 2 K |
Ambient diffraction temperature | 223 ± 2 K |
Number of distinct elements | 4 |
Space group number | 114 |
Hermann-Mauguin space group symbol | P -4 21 c |
Hall space group symbol | P -4 2n |
Residual factor for all reflections | 0.1257 |
Residual factor for significantly intense reflections | 0.0758 |
Weighted residual factors for significantly intense reflections | 0.1208 |
Weighted residual factors for all reflections included in the refinement | 0.1403 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.144 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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