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. Author manuscript; available in PMC: 2012 Sep 19.
Published in final edited form as: Inorg Chem. 2011 Aug 2;50(18):9114–9121. doi: 10.1021/ic201292t

Table 1.

Brief crystallographic data and data collection parameters

[Fe(oxoOEC•/2)(Cl)]2SbCl6

Formula C36H44ClFeN4·0.5SbCl6·CH2Cl2
FW 892.2
a, Å 10.333(2)
b, Å 12.555(3)
c, Å 15.849(3)
α, deg 83.64(3)
β, deg 77.53(3)
γ, deg 87.19(3)
V, Å3 1994.6(7)
Z 2
Space group P1
Dc, g/cm3 1.486
F(000) 915
μ, mm–1 1.146
Radiation (λ, Å) 0.71073
Temperature, K 127(2)
Final R indices [I > 2 σ(I)] R1 = 0.0983; wR2 = 0.2397
Final R indices [for all data] R1 = 0.1633; wR2 = 0.2935