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Information card for entry 4064756
Preview
Coordinates | 4064756.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C62 H82 Ga La N2 O |
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Calculated formula | C62 H82 Ga La N2 O |
SMILES | C12=C(c3c4c1cccc4ccc3)N([Ga](N2c1c(cccc1C(C)C)C(C)C)[La]12345678([c]9([c]4([c]3([c]2([c]19C)C)C)C)CC)([c]1(CC)[c]5([c]6([c]7([c]81C)C)C)C)[O]1CCCC1)c1c(cccc1C(C)C)C(C)C |
Title of publication | Compounds with Direct Gallium‒Lanthanum and Gallium‒Zinc Bonds |
Authors of publication | Fedushkin, Igor L.; Lukoyanov, Anton N.; Tishkina, Alexandra N.; Maslov, Maxim O.; Ketkov, Sergey Yu.; Hummert, Markus |
Journal of publication | Organometallics |
Year of publication | 2011 |
Journal volume | 30 |
Journal issue | 13 |
Pages of publication | 3628 |
a | 18.9721 ± 0.0003 Å |
b | 12.3265 ± 0.0002 Å |
c | 23.8937 ± 0.0004 Å |
α | 90° |
β | 102.323 ± 0.002° |
γ | 90° |
Cell volume | 5459.03 ± 0.16 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 6 |
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 | 0.1207 |
Residual factor for significantly intense reflections | 0.0638 |
Weighted residual factors for significantly intense reflections | 0.1928 |
Weighted residual factors for all reflections included in the refinement | 0.212 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.038 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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