Five Isolated Pentagon Rule Isomers of Higher Fullerene C94 Captured as Chlorides and CF3 Derivatives: C94(34)Cl14, C94(61)Cl20, C94(133)Cl22, C94(42)(CF3)16, and C94(43)(CF3)18
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https://figshare.com/articles/dataset/Five_Isolated_Pentagon_Rule_Isomers_of_Higher_Fullerene_C_sub_94_sub_Captured_as_Chlorides_and_CF_sub_3_sub_Derivatives_C_sub_94_sub_34_Cl_sub_14_sub_C_sub_94_sub_61_Cl_sub_20_sub_C_sub_94_sub_133_Cl_sub_22_sub_C_sub_94_sub_42_CF_sub_3_sub_sub_16_sub_and_/2559304
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High-temperature chlorination and trifluoromethylation of C94 isomeric mixtures followed by single-crystal X-ray diffraction with the use of synchrotron radiation resulted in the structure determination of C94(34)Cl14, C94(61)Cl20, C94(133)Cl22, C94(42)(CF3)16, and C94(43)(CF3)18. Their addition patterns are stabilized by the formation of isolated CC bonds and aromatic substructures. Four cage isomers of C94 (nos. 34, 42, 43, and 133) have been experimentally confirmed for the first time.
创建时间：
2016-02-22
