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Information card for entry 4344727
Preview
Coordinates | 4344727.cif |
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Original paper (by DOI) | HTML |
Formula | C30 H60 N8 Ti |
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Calculated formula | C30 H60 N8 Ti |
SMILES | [Ti]1(N(C)C)(N(C)C)([N](=C(N1C1CCCCC1)N(C)C)C1CCCCC1)N=C1N(C=CN1C(C)(C)C)C(C)(C)C |
Title of publication | Imidazolin-2-iminato Ligand-Supported Titanium Complexes as Catalysts for the Synthesis of Urea Derivatives. |
Authors of publication | Naktode, Kishor; Das, Suman; Bhattacharjee, Jayeeta; Nayek, Hari Pada; Panda, Tarun K. |
Journal of publication | Inorganic chemistry |
Year of publication | 2016 |
Journal volume | 55 |
Journal issue | 3 |
Pages of publication | 1142 - 1153 |
a | 16.4234 ± 0.001 Å |
b | 9.6163 ± 0.0003 Å |
c | 21.2742 ± 0.0007 Å |
α | 90° |
β | 92.015 ± 0.004° |
γ | 90° |
Cell volume | 3357.8 ± 0.3 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 4 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0447 |
Residual factor for significantly intense reflections | 0.0378 |
Weighted residual factors for significantly intense reflections | 0.0977 |
Weighted residual factors for all reflections included in the refinement | 0.1028 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.033 |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4344727.html
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