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- W1966322998 abstract "A single MoFe3S4 cubane-like cluster compound has been synthesized through spontaneous self-assembly of simple inorganic salts with organosulfur ligand for the first time. (Et4N)-(MoFe3S4(Et2NCSS)5] CH3CN(1) is quite stable in air. The crystal of 1 is monoclinic with space group P2/c, a=22.897 (3)A, b= 12.399 (2)A, c=20.928 (4)A, β=97.15 (1)°, and Z=4. A full matrix least-squares refinement with 6725 unique reflections for all nonhydrogen atoms gives R=0.068.The anion of 1 is the first isolated single MoFe3S4 cubane cluster with core oxidation state [MoFe3S4]4+. The distance between the two 6-coordinate metal atoms (Mo, Fe) is 2.624 A, which is the shortest M-M' bond observed for Mo-Fe-S clusters so far and the only one shorter than similar distances in FeMo-cofactor.The bond orders of this anion were calculated by EHMO method and the results coincide with the general rule. The structural feature and the unusual stability of 1 can be attributed to the bidentate chelating effect of Et2NCSS-, which leads to high coordination of metal atoms and the various ligated types." @default.
- W1966322998 created "2016-06-24" @default.
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- W1966322998 date "1986-06-01" @default.
- W1966322998 modified "2023-09-27" @default.
- W1966322998 title "Investigation of single MoFe3S4 cubane cluster: I. First successful synthesis by spontaneous self-assembly reaction and structure of (Et4N) [MoFe3S4(Et2NCSS)5]CH3CN" @default.
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- W1966322998 doi "https://doi.org/10.1002/cjoc.19860040202" @default.
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