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. 2018 Mar 23;9(15):3767–3781. doi: 10.1039/c8sc00890f

Table 3. Selected variable-temperature X-ray crystallographic data for complex 1pF.

Space group/temperature, K
I2/111 a I2/200 Cc/240
V/Z3 577.09(5) 588.17(4) 614.7(1)
(C)I···F(Ni)/Å 2.652(3) 2.683(5) 2.707(7)
Ni–F/Å 1.839(4) 1.832(5) 1.855(10)
Ni–C/Å 1.872(10) 1.879(10) 1.88(2)
Ni–P/Å 2.211(1) 2.214(1) 2.209(5)
C–I···X/° 180.0 180.0 177.8(7)
I···X–Ni/° 180.0 180.0 164.8(7)
Angle/° between adjacent metal planes b 0.0 0.0 26.3(7)
Angle/° between adjacent ring planes 0.0 0.0 4.9(10)
Ni···Ni···Ni/° 180.0 180.0 171.50(3)

aIndependent determination from 110 K study reported in Tables 1 and 2.

bMetal plane Ni–P1–P2–C1–X.