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Information card for entry 7005639
Preview
Coordinates | 7005639.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C27 H21 Cd2 Cl N18 O4 |
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Calculated formula | C27 H21 Cd2 Cl N18 O4 |
SMILES | [Cd]12345[n]6cccnc6[N]1=CN1[Cd]67([n]8c1nccc8)([N](=CN3c1nccc[n]21)c1nccc[n]61)N(C=[N]5c1nccc[n]41)c1nccc[n]71.Cl(=O)(=O)(=O)[O-] |
Title of publication | Crystal structures and solution behaviors of dinuclear d(10)-metal complexes containing anions of N,N'-bis(pyrimidine-2-yl)formamidine. |
Authors of publication | Chan, Zhi-Kai; Chen, Tsun-Ren; Chen, Jhy-Der; Wang, Ju-Chun; Liu, C. W. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2007 |
Journal issue | 31 |
Pages of publication | 3450 - 3458 |
a | 24.002 ± 0.003 Å |
b | 12.6232 ± 0.0016 Å |
c | 32.299 ± 0.004 Å |
α | 90° |
β | 111.264 ± 0.008° |
γ | 90° |
Cell volume | 9120 ± 2 Å3 |
Cell temperature | 295 ± 2 K |
Ambient diffraction temperature | 295 ± 2 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 all reflections | 0.0993 |
Residual factor for significantly intense reflections | 0.0496 |
Weighted residual factors for significantly intense reflections | 0.113 |
Weighted residual factors for all reflections included in the refinement | 0.1235 |
Goodness-of-fit parameter for all reflections included in the refinement | 1 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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