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Information card for entry 7007201
Preview
Coordinates | 7007201.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C34 H38 N2 O10 Ti2 |
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Calculated formula | C34 H38 N2 O10 Ti2 |
SMILES | c12cccc3C(=O)O[Ti]4567([n]23)(O[Ti]2389%10%11([n]%12c(cccc%12C(=O)O3)C(=O)O2)[c]2([c]9([c]%10([c]%11([c]82C)C)C)C)C)(OC1=O)[c]1([c]4([c]5([c]6([c]71C)C)C)C)C.O |
Title of publication | A new titanium building block for early-late heterometallic complexes; preparation of a new tetrameric metallomacrocycle by self assembly. |
Authors of publication | Fandos, Rosa; Gallego, Beatriz; Otero, Antonio; Rodríguez, Ana; Ruiz, María José; Terreros, Pilar; Pastor, Cesar |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2006 |
Journal issue | 22 |
Pages of publication | 2683 - 2690 |
a | 16.21 ± 0.002 Å |
b | 14.42 ± 0.003 Å |
c | 14.711 ± 0.004 Å |
α | 90° |
β | 104.87 ± 0.03° |
γ | 90° |
Cell volume | 3323.5 ± 1.3 Å3 |
Cell temperature | 290 ± 2 K |
Ambient diffraction temperature | 290 ± 2 K |
Number of distinct elements | 5 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0521 |
Residual factor for significantly intense reflections | 0.04 |
Weighted residual factors for significantly intense reflections | 0.1233 |
Weighted residual factors for all reflections included in the refinement | 0.1384 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.117 |
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/7007201.html
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