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Information card for entry 7716214
Preview
Coordinates | 7716214.cif |
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Original paper (by DOI) | HTML |
Chemical name | dichloro-bis(4-Formyl-5-methylimidazole-N,O)-cadmium(II) |
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Formula | C10 H12 Cd Cl2 N4 O2 |
Calculated formula | C10 H12 Cd Cl2 N4 O2 |
Title of publication | Exploring Novel Cd(II) Complexes with 5-Methyl-4-Imidazolecarboxaldehyde: Synthesis, Structure, Computational Insights, and Affinity to DNA through switchSense Methodology |
Authors of publication | Kowalik, Mateusz; Nowicka, Paulina; Brzeski, Jakub; Żukowska, Natalia; Masternak, Joanna; Kazimierczuk, Katarzyna; Makowski, Mariusz |
Journal of publication | Dalton Transactions |
Year of publication | 2024 |
a | 7.132 ± 0.003 Å |
b | 8.627 ± 0.004 Å |
c | 12.649 ± 0.006 Å |
α | 69.79 ± 0.04° |
β | 75.84 ± 0.04° |
γ | 78.74 ± 0.04° |
Cell volume | 702.9 ± 0.6 Å3 |
Cell temperature | 120 ± 2 K |
Ambient diffraction temperature | 120 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0649 |
Residual factor for significantly intense reflections | 0.0561 |
Weighted residual factors for significantly intense reflections | 0.1532 |
Weighted residual factors for all reflections included in the refinement | 0.1604 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.054 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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