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. Author manuscript; available in PMC: 2021 Jul 26.
Published in final edited form as: Inorg Chem. 2018 Feb 7;57(4):1935–1949. doi: 10.1021/acs.inorgchem.7b02748

Table 1.

Selected M—L Bond Distances (Å) for 1–5

1 2 3 4 5
M(1)–S(1) 2.284(1) 2.2734(3) 2.2883(8) 2.3930(5) 2.271(1)
M(1)–S(2) 2.290(1)a 2.2789(4)a 2.3109(8) 2.4653(5) N/A
M(2)–S(1) N/A N/A 2.2965(8) 2.4616(5) N/A
M(2)–S(2) N/A N/A 2.2825(8) 2.3912(5) N/A
M(1)–N(1)imine 1.908(4) 1.949(1) 1.917(2) 2.162(2) 1.948(4)
M(1)–N(2)imine 1.916(4) 1.949(1) 1.923(2) 2.145(2) 1.941(4)
M(1)–N(3)NHet 1.997(4) 1.996(1) 1.955(2) 2.141(2) 1.996(4)
M(1)–N(4)NHet 1.984(4) 1.987(1) 1.966(2 2.120(2) 1.981(4)
M(2)–N(7)imine N/A N/A 1.933(2) 2.123(2) N/A
M(2)–N(8)imine N/A N/A 1.925(2) 2.2078(16) N/A
M(2)–N(9)NHet N/A N/A 1.970(2) 2.121(2) N/A
M(2)–N(10)NHet N/A N/A 1.973(2) 2.156(2) N/A
a

For this structure, S(2) and Fe(2) are related to S(1) and Fe(1) via a crystallographic inversion center, and are thus labeled S(1)′ or Fe(1′) in the supplemental crystallographic tables (Supporting Information), where S(1) and S(1)′ are derived from two different pentadentate ligands.