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. 2021 Aug 27;6(36):23578–23587. doi: 10.1021/acsomega.1c03732

Table 3. Comparison of Ba–O and Ba–N Bond Lengths (pm) as Well as Selected Bond Angles (Deg) in Trinuclear Complexes 3 and 4.

  3 4 4
complex   molecule A molecule B
Ba1–O1 280.7(3) 276.9(8) 283.0(7)
Ba2–O1 270.6(3) 260.9(7) 264.5(7)
Ba2–O2 263.7(3) 262.3(7) 264.3(9)
Ba3–O2 281.9(3) 281.7(7) 277.6(9)
Ba1–N1 269.4(4) 272.5(8) 273.3(8)
Ba3–N2 279.2(3) 271.9(8) 270.6(10)
Ba1–N1–CMes 124.3(3) 130.2(7) a
Ba3–N2–CMes 137.1(3) 132.0(7) 125.8(10)
P1–N1–CMes 134.3(4) 127.2(7) a
P2–N2–CMes 123.0(3) 127.8(8) 133.3(10)
Ba1···Ba2 396.17(6) 396.17(13) 398.24(16)
Ba2···Ba3 411.59(6) 396.89(13) 397.84(18)
a

The mesityl group at N1B in molecule 4B is disordered on two sites with Ba1–N1–CMes and P1–N1–CMes bond-angle pairs of 120.5(13)/131.8(17)° and 138.3(13)/127.8(17)°, respectively.