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Information card for entry 7030931
Preview
Coordinates | 7030931.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C44 H58 Cl8 N20 O44 Pb4 |
---|---|
Calculated formula | C44 H58 Cl8 N20 O44 Pb4 |
SMILES | C1c2cccc3C=[N]4N(C)c5cc6[n](c(C)[n]5[Pb]4([n]23)([OH]1)(OCl(=O)(=O)=O)OCl(=O)(=O)=O)[Pb]1([N](=Cc2cc3C=[N]4N(C)c5cc7[n](c(C)[n]5[Pb]4([n]3c(c3ccccc3)[n]12)(OCl(=O)(=O)=O)OCl(=O)(=O)=O)[Pb]12([N](=Cc3cccc(C[OH]2)[n]13)N7C)[OH2])N6C)([OH2])OCl(=O)(=O)=O.CN(=O)=O.CN(=O)=O.CN(=O)=O.CN(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O |
Title of publication | Tetratopic pyrimidine-hydrazone ligands modified with terminal hydroxymethyl and acryloyl arms and their Pb(ii), Zn(ii), Cu(ii) and Ag(i) complexes. |
Authors of publication | Hutchinson, Daniel J.; Hanton, Lyall R.; Moratti, Stephen C. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2014 |
Journal volume | 43 |
Journal issue | 22 |
Pages of publication | 8205 - 8218 |
a | 9.2296 ± 0.001 Å |
b | 17.3147 ± 0.0018 Å |
c | 25.755 ± 0.003 Å |
α | 102.491 ± 0.004° |
β | 93.675 ± 0.004° |
γ | 104.479 ± 0.004° |
Cell volume | 3860.3 ± 0.7 Å3 |
Cell temperature | 90 ± 2 K |
Ambient diffraction temperature | 90 ± 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 | 0.071 |
Residual factor for significantly intense reflections | 0.0565 |
Weighted residual factors for significantly intense reflections | 0.1297 |
Weighted residual factors for all reflections included in the refinement | 0.139 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.027 |
Diffraction radiation wavelength | 0.71069 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7030931.html
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