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Information card for entry 7116204
Preview
Coordinates | 7116204.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C28 H245 N7 Na12 O268 Se8 Sn7 W54 |
---|---|
Calculated formula | C28 N7 Na O206.5 Se8 Sn7 W54 |
SMILES | C[Sn]12([O]=[W]345(O[W]67(O[W]89%10(O[W]%11%12(O[W]%13%14([O]%11[Se](=[O]%10[W]%10(O[W]%11%15%16(O[W]%17%18(O[W]%19%20(O[W]%21%22%23(O[W]%24(O[W]%25%26(=[O][Sn](C)(C)([O]=[W]%27%28%29([O]%30=[Se]%31[O]%32[W]%33%34%35(=[O][Sn](C)(C)([O]=%14)[O]=[W](O[W]%14%36([O]%31[W](O[W]%31%30(O[W]%32(O[W]%30%32%37(O[W]%38%39(O%31)([O]%31[Se]%40=[O]%32[W](O%34)(O[W]%32%34(O%30)([O]%40[W](O%38)(O%32)(O[W]%31(O%28)(O%39)(=O)=O)(=[O][Sn](C)(C)[O]=%34)=O)=O)(O%37)(=O)=O)=O)=O)(O%33)(O%14)=O)(O%27)=O)(O%26)(O%29)(O%36)=O)(=O)O%35)(O%25)(O%22)(O[W]%14(O%21)(O[W]([O]%14=[Se]([O]%23%24)[O]%11%17)(O%12)(=O)(O%18)O%20)(O%13)=O)=O)=O)=O)[O]=%10)(O%15)=O)(O%19)(O%16)=O)=O)=O)(O8)=O)=O)(O7)(=O)O9)[O]36)(=O)O5)(O4)=O)=O)(=[O]1)=O)=O)([O]=[W]134(=O)[O]5[Se]6=[O]7[W]89(O[W]%10%11%12(O[W]%13(O[W]%14%15%16(O[W]%17%18(O[W]%19%20(O[W]%21%22%23(O[W]7(O4)(O9)(=[O][Sn]4(C)(C)[O]=[W]79%24(O[W]%25%26(O[W]%27%28%29(O[W]%30%31(=[O][Sn](C)(C)[O]=[W]%32%33(O%30)([O]%31[Se](=[O]%26%29)[O]%26[W]%29(O[W]%26(O[W]%26%30%31(O[W]%34%35(O[W]%36(O%27)(O7)([O]9[Se](=[O]%26%34)[O]7[W]9(O[W]%26(O[W](O[W]7(O%36)(O9)(O%24)=O)(O%21)(=[O]4)(O[W]47(O[W](O%26)(O%15)([O]7[Se](=[O]%16%17)[O]%19%22)(O[W](O4)(O%18)(O%20)=O)=O)(O%23)=O)=O)(O%14)(=[O][Sn](C)(C)([O]=%31)[O]=%13)=O)(O%35)(=O)O%30)=O)(O%29)=O)=O)(=O)(O%33)=O)(O%28)(O%32)=O)=O)(O%25)=O)=O)(=O)=O)=O)=O)=O)(O8)=O)(O%12)=O)=O)(=O)([O]6%10)O[W]5(O1)(=[O]2)(O%11)=O)=O)(O3)=O)C.[NH2+](C)C.[NH2+](C)C.[NH2+](C)C.[NH2+](C)C.[NH2+](C)C.[NH2+](C)C.[NH2+](C)C.[Na+].O.O.O.O.O.O.O |
Title of publication | Assembly of tetrameric dimethyltin-functionalized selenotungstates: from nanoclusters to one-dimensional chains. |
Authors of publication | Chen, Wei-Chao; Qin, Chao; Li, Yang-Guang; Zang, Hong-Ying; Shao, Kui-Zhan; Su, Zhong-Min; Wang, En-Bo; Liu, Hong-Sheng |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2015 |
Journal volume | 51 |
Journal issue | 12 |
Pages of publication | 2433 - 2436 |
a | 33.9004 ± 0.0014 Å |
b | 36.2831 ± 0.0014 Å |
c | 28.2841 ± 0.0011 Å |
α | 90° |
β | 110.239 ± 0.0007° |
γ | 90° |
Cell volume | 32642 ± 2 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 8 |
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 | 0.1201 |
Residual factor for significantly intense reflections | 0.0564 |
Weighted residual factors for significantly intense reflections | 0.1166 |
Weighted residual factors for all reflections included in the refinement | 0.1277 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.986 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7116204.html
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