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Information card for entry 7031308
Preview
| Coordinates | 7031308.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | HS183 |
|---|---|
| Formula | C41 H73 B20 Cu2 N7 P2 Sn2 |
| Calculated formula | C41 H73 B20 Cu2 N7 P2 Sn2 |
| SMILES | C([P]12c3c(cccc3)[N](C)(C)[Cu]2([N](c2c1cccc2)(C)C)[N]#CC)[P]12c3c(cccc3)[N](C)(C)[Cu]2([N](c2c1cccc2)(C)C)[N]#CC.[CH]1234[BH]567[BH]89%10[BH]%11%12%13[BH]%141([BH]1%152[BH]235[BH]368[BH]59%11[BH]%12%141[BH]%15235)[Sn]47%10%13.[CH]1234[BH]567[BH]89%10[BH]%11%12%13[BH]%141([BH]1%152[BH]235[BH]368[BH]59%11[BH]%12%141[BH]%15235)[Sn]47%10%13.C(#N)C |
| Title of publication | Dinuclear copper complexes: coordination of Group 14 heteroborates. |
| Authors of publication | Scheel, Holger; Wiederkehr, Jessica; Eichele, Klaus; Mayer, Hermann A.; Winter, Florian; Pöttgen, Rainer; Wesemann, Lars |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2014 |
| Journal volume | 43 |
| Journal issue | 31 |
| Pages of publication | 11867 - 11876 |
| a | 10.5306 ± 0.0003 Å |
| b | 14.5334 ± 0.0004 Å |
| c | 20.3679 ± 0.0006 Å |
| α | 92.217 ± 0.002° |
| β | 95.158 ± 0.002° |
| γ | 107.583 ± 0.002° |
| Cell volume | 2952.42 ± 0.15 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 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 | 0.0727 |
| Residual factor for significantly intense reflections | 0.0354 |
| Weighted residual factors for significantly intense reflections | 0.0699 |
| Weighted residual factors for all reflections included in the refinement | 0.0757 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.902 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180019 (current) | 2016-03-25 | cif/7/03/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/03/13. |
7031308.cif |
| 121654 | 2014-08-08 | cif/ Updating files of 7031303, 7031304, 7031305, 7031306, 7031307, 7031308 Original log message: Adding full bibliography for 7031303--7031308.cif. |
7031308.cif |
| 116490 | 2014-06-13 | cif/ Adding structures of 7031303, 7031304, 7031305, 7031306, 7031307, 7031308 via cif-deposit CGI script. |
7031308.cif |
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