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表3 b-b方法所得的并五苯自旋-自旋耦合常数nJ(C, C) (单位：Hz)

化合物 1J(C, C) calc. exp. [27] 2J(C, C) calc. exp. [27] 3J(C, C) calc. exp. [27] 4J(C, C) calc. exp. [27] 1C, 2C 68.60 60.40 1C, 3C ?1.19 1C, 4C 7.86 1C, 15C ?0.33 1C, 6C 59.65 1C, 5C ?1.85 ?2.45 1C, 10C 5.43 5.51 1C, 11C ?0.15 2C, 3C 62.26 55.87 2C, 4C 0.04 0.20 2C, 5C 8.02 2C, 14C ?1.54 ?1.47 3C, 4C 57.63 2C, 10C 2.43 2C, 11C 2.86 12C, 9C 59.73 12C, 10C ?4.02 25C, 26C 17.10 9C, 5C ?5.43 9C, 10C 73.77 9C, 1C ?3.85 2C, 5C 13.99 10C, 25C ?4.85 10C, 1C 62.76 10C, 2C ?1.51 10C, 11C 9.66 1C, 17C ?3.52 1C, 2C 74.67 10C, 6C ?2.10 1C, 12C 9.79 1C, 26C ?6.52 1C, 6C 57.82 1C, 3C ?4.13 1C, 4C 9.62 2C, 3C 69.45 2C, 25C ?5.70 9C, 2C 10.05 3C, 25C 72.82 2C, 6C ?4.53 10C, 3C 7.87 3C, 4C 57.63 2C, 4C ?4.21 1C, 25C 10.96 3C, 17C ?4.48 5C, 10C 6.57 4C, 25C ?5.23 5C, 25C 11.04