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Information card for entry 4324873
Preview
| Coordinates | 4324873.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C32 H46 Cu N4 O4 |
|---|---|
| Calculated formula | C32 H46 Cu N4 O4 |
| SMILES | c1(c(C2=N[N]([Cu]3(O2)[N](=C(CCCC)CCCC)N=C(c2c(cccc2)O)O3)=C(CCCC)CCCC)cccc1)O |
| Title of publication | Spacer-Dependent Structural and Physicochemical Diversity in Copper(II) Complexes with Salicyloyl Hydrazones: A Monomer and Soluble Polymers |
| Authors of publication | Dariusz Matoga; Janusz Szklarzewicz; Ryszard Gryboś; Katarzyna Kurpiewska; Wojciech Nitek |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2011 |
| Journal volume | 50 |
| Pages of publication | 3501 - 3510 |
| a | 8.122 ± 0.0004 Å |
| b | 9.394 ± 0.0004 Å |
| c | 11.966 ± 0.0005 Å |
| α | 95.922 ± 0.003° |
| β | 102.409 ± 0.003° |
| γ | 114.53 ± 0.002° |
| Cell volume | 791.93 ± 0.07 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0607 |
| Residual factor for significantly intense reflections | 0.055 |
| Weighted residual factors for significantly intense reflections | 0.1557 |
| Weighted residual factors for all reflections included in the refinement | 0.1618 |
| Goodness-of-fit parameter for significantly intense reflections | 6.637 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.051 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179351 (current) | 2016-03-23 | cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/48. |
4324873.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4324873.cif |
| 43324 | 2012-03-14 | ../uploads/cif-deposit/cod/cif Adding structures of 4324873 via cif-deposit CGI script. |
4324873.cif |
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Users of the data should acknowledge the original authors of the
structural data.