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Information card for entry 7020252
Preview
Coordinates | 7020252.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C32 H29 N4 O2 P Pd S |
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Calculated formula | C32 H29 N4 O2 P Pd S |
SMILES | [Pd]12(Oc3c(C=[N]2N=C(S1)N(C)C)cc1c(ccc(c1)OC)n3)[P](c1ccccc1)(c1ccccc1)c1ccccc1 |
Title of publication | Mixed ligand palladium(ii) complexes of 6-methoxy-2-oxo-1,2-dihydroquinoline-3-carbaldehyde 4N-substituted thiosemicarbazones with triphenylphosphine co-ligand: Synthesis, crystal structure and biological properties. |
Authors of publication | Ramachandran, Eswaran; Senthil Raja, Duraisamy; Bhuvanesh, Nattamai S. P.; Natarajan, Karuppannan |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2012 |
Journal volume | 41 |
Journal issue | 43 |
Pages of publication | 13308 - 13323 |
a | 9.8863 ± 0.0003 Å |
b | 11.3723 ± 0.0004 Å |
c | 13.914 ± 0.0005 Å |
α | 101.755 ± 0.002° |
β | 105.532 ± 0.002° |
γ | 103.784 ± 0.002° |
Cell volume | 1402.71 ± 0.09 Å3 |
Cell temperature | 110 ± 2 K |
Ambient diffraction temperature | 110 ± 2 K |
Number of distinct elements | 7 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.025 |
Residual factor for significantly intense reflections | 0.0224 |
Weighted residual factors for significantly intense reflections | 0.0544 |
Weighted residual factors for all reflections included in the refinement | 0.055 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.054 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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