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Information card for entry 7029455
Preview
Coordinates | 7029455.cif |
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Original paper (by DOI) | HTML |
Formula | C17 H23 Cl N2 O3 |
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Calculated formula | C17 H23 Cl N2 O3 |
SMILES | Oc1c(ccc(N(CC)CC)c1)/C=[NH+]/c1c(O)cccc1.[Cl-].O |
Title of publication | A remarkable effect of N,N-diethylamino functionality on the optoelectronic properties of a salicylimine-based probe for Al(3+). |
Authors of publication | Neeraj,; Kumar, Ajit; Kumar, Virendra; Prajapati, Rahul; Asthana, Sharad Kumar; Upadhyay, K. K.; Zhao, Jianzhang |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2014 |
Journal volume | 43 |
Journal issue | 15 |
Pages of publication | 5831 - 5839 |
a | 18.242 ± 0.005 Å |
b | 11.925 ± 0.005 Å |
c | 17.097 ± 0.005 Å |
α | 90 ± 0.005° |
β | 108.114 ± 0.005° |
γ | 90 ± 0.005° |
Cell volume | 3535 ± 2 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 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 | 0.1826 |
Residual factor for significantly intense reflections | 0.0662 |
Weighted residual factors for significantly intense reflections | 0.0832 |
Weighted residual factors for all reflections included in the refinement | 0.1166 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.979 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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