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Information card for entry 7040698
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Coordinates | 7040698.cif |
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Original paper (by DOI) | HTML |
Formula | C30 H48 N4 O2 |
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Calculated formula | C30 H48 N4 O2 |
Title of publication | Syntheses, crystal structures and steady state and time-resolved fluorescence properties of a PET based macrocycle and its dinuclear Zn(II)/Cd(II)/Hg(II) complexes. |
Authors of publication | Mandal, Leena; Majumder, Samit; Mohanta, Sasankasekhar |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2016 |
Journal volume | 45 |
Journal issue | 43 |
Pages of publication | 17365 - 17381 |
a | 15.402 ± 0.003 Å |
b | 11.1432 ± 0.0019 Å |
c | 17.153 ± 0.003 Å |
α | 90° |
β | 92.045 ± 0.002° |
γ | 90° |
Cell volume | 2942.1 ± 0.9 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 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 | 0.0724 |
Residual factor for significantly intense reflections | 0.0531 |
Weighted residual factors for significantly intense reflections | 0.161 |
Weighted residual factors for all reflections included in the refinement | 0.1763 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.019 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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The link is: https://www.crystallography.net/7040698.html
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structural data.