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Information card for entry 7032903
Preview
Coordinates | 7032903.cif |
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Original paper (by DOI) | HTML |
Formula | C22 H13 Fe N O5 |
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Calculated formula | C22 H13 Fe N O5 |
SMILES | [Fe]1([CH](C(=O)c2cc3ccccc3cc2)=[CH]1c1ncccc1)(C#[O])(C#[O])(C#[O])C#[O] |
Title of publication | An expedient approach to synthesize fluorescent 3-substituted 4H-quinolizin-4-ones via (η(4)-vinylketene)-Fe(CO)3 complexes. |
Authors of publication | Rosas-Sánchez, Alfredo; Toscano, Rubén A; López-Cortés, José G; Ortega-Alfaro, M Carmen |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2015 |
Journal volume | 44 |
Journal issue | 2 |
Pages of publication | 578 - 590 |
a | 10.5432 ± 0.0004 Å |
b | 15.2269 ± 0.0005 Å |
c | 12.0419 ± 0.0004 Å |
α | 90° |
β | 91.721 ± 0.001° |
γ | 90° |
Cell volume | 1932.34 ± 0.12 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298 ± 2 K |
Number of distinct elements | 5 |
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 | 0.0448 |
Residual factor for significantly intense reflections | 0.0349 |
Weighted residual factors for significantly intense reflections | 0.0868 |
Weighted residual factors for all reflections included in the refinement | 0.0934 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.017 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7032903.html
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