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Information card for entry 4310634
Preview
| Coordinates | 4310634.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C50 H48 Cu2 N4 O8 S4 |
|---|---|
| Calculated formula | C50 H48 Cu2 N4 O8 S4 |
| Title of publication | Synthesis, Crystal Structure, and Spectroscopic Characterization of trans-Bis[(μ-1,3-bis(4-pyridyl)propane)(μ-(3-thiopheneacetate-O)) (3-thiopheneacetate-O)]dicopper(II), {[Cu2(O2CCH2C4H3S)4μ-(BPP)2]}n: From a Dinuclear Paddle-Wheel Copper(II) Unit to a 2-D Coordination Polymer Involving Monatomic Carboxylate Bridges |
| Authors of publication | Maria Vanda Marinho; Maria Irene Yoshida; Kassilio J. Guedes; Klaus Krambrock; Adailton J. Bortoluzzi; Manfredo Hörner; Flávia C. Machado; Wagner M. Teles |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2004 |
| Journal volume | 43 |
| Pages of publication | 1539 - 1544 |
| a | 9.4253 ± 0.001 Å |
| b | 10.9373 ± 0.001 Å |
| c | 23.6378 ± 0.001 Å |
| α | 90° |
| β | 98.733 ± 0.004° |
| γ | 90° |
| Cell volume | 2408.5 ± 0.4 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.081 |
| Residual factor for significantly intense reflections | 0.0386 |
| Weighted residual factors for significantly intense reflections | 0.1092 |
| Weighted residual factors for all reflections included in the refinement | 0.128 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.954 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179145 (current) | 2016-03-23 | cif/4/31/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/31/06. |
4310634.cif |
| 120093 | 2014-07-12 | Adding DOIs to range 4/31 structures. | 4310634.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4310634.cif |
| 32063 | 2012-01-26 | cif/4 Correction of volume and publication year for files coming from a couple of issues of Inorg. Chem. The mistake was made when fetching bibliography for these entries and detected just now. I have checked that all other Inorg. Chem. files are correct. |
4310634.cif |
| 2122 | 2010-11-08 | ../uploads/cif-deposit/cod/cif Adding structures of 4310634 via cif-deposit CGI script. |
4310634.cif |
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