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Information card for entry 7224446
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Coordinates | 7224446.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | Erdppz2 |
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Formula | C36 H20 Cl3 Er N8 |
Calculated formula | C36 H20 Cl3 Er N8 |
SMILES | c1ccc2c3c(c4ccc[n]5c4c2[n]1[Er]15(Cl)(Cl)(Cl)[n]2cccc4c5c(c6ccc[n]1c6c24)nc1ccccc1n5)nc1c(cccc1)n3 |
Title of publication | Photosensitized samarium(iii) and erbium(iii) complexes of planar N,N-donor heterocyclic bases: crystal structures and evaluation of biological activity |
Authors of publication | Dasari, Srikanth; Abbas, Zafar; Kumar, Priyaranjan; Patra, Ashis K. |
Journal of publication | CrystEngComm |
Year of publication | 2016 |
Journal volume | 18 |
Journal issue | 23 |
Pages of publication | 4313 |
a | 21.54 ± 0.004 Å |
b | 17.225 ± 0.003 Å |
c | 19.377 ± 0.004 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 7189 ± 2 Å3 |
Cell temperature | 100 K |
Ambient diffraction temperature | 100 K |
Number of distinct elements | 5 |
Space group number | 56 |
Hermann-Mauguin space group symbol | P c c n |
Hall space group symbol | -P 2ab 2ac |
Residual factor for all reflections | 0.0445 |
Residual factor for significantly intense reflections | 0.0343 |
Weighted residual factors for significantly intense reflections | 0.0825 |
Weighted residual factors for all reflections included in the refinement | 0.0872 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.049 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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