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Information card for entry 7023100
Preview
Coordinates | 7023100.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C46 H42 Cd Cl2 N6 O8 |
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Calculated formula | C46 H42 Cd Cl2 N6 O8 |
SMILES | [C@@H]12CCCC[C@@H]2[N]23[Cd]45([N]1(Cc1ccc6ccccc6[n]41)Cc1[n]5c4ccccc4cc1)([n]1c(C2)ccc2ccccc12)[n]1c(C3)ccc2ccccc12.[C@H]12CCCC[C@H]2[N]23[Cd]45([N]1(Cc1ccc6ccccc6[n]41)Cc1[n]5c4ccccc4cc1)([n]1c(C2)ccc2ccccc12)[n]1c(C3)ccc2ccccc12.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O |
Title of publication | Quinoline-based fluorescent zinc sensors with enhanced fluorescence intensity, Zn/Cd selectivity and metal binding affinity by conformational restriction. |
Authors of publication | Mikata, Yuji; Sato, Yumi; Takeuchi, Saaya; Kuroda, Yasuko; Konno, Hideo; Iwatsuki, Satoshi |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2013 |
Journal volume | 42 |
Journal issue | 26 |
Pages of publication | 9688 - 9698 |
a | 15.659 ± 0.0006 Å |
b | 20.5854 ± 0.0005 Å |
c | 13.7274 ± 0.0005 Å |
α | 90° |
β | 112.878 ± 0.0014° |
γ | 90° |
Cell volume | 4076.9 ± 0.2 Å3 |
Cell temperature | 123 K |
Ambient diffraction temperature | 123 K |
Number of distinct elements | 6 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for significantly intense reflections | 0.0552 |
Weighted residual factors for all reflections included in the refinement | 0.1411 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.049 |
Diffraction radiation wavelength | 0.7107 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/7023100.html
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