Table 3.

Selected Bond Lengths (Å) and Angles (deg) for 13 - 15

Bond lengths		Bond angles
13
Fe(1)-O(1)	2.097(2)	O(1)-Fe(1)-O(2)	59.86(7)
Fe(1)-O(2)	2.281(2)	O(1)-Fe(1)-O(3)	150.71(8)
Fe(1)-O(3)	2.087(2)	O(1)-Fe(1)-O(4)	97.29(7)
Fe(1)-O(4)	2.257(2)	O(3)-Fe(1)-O(4)	60.57(7)
Fe(1)-N(1)	2.145(2)	O(2)-Fe(1)-O(4)	85.71(7)
Fe(1)-N(2)	2.202(2)	O(1)-Fe(1)-N(1)	109.59(9)
		O(1)-Fe(1)-N(2)	100.88(9)
		O(2)-Fe(1)-N(1)	105.27(9)
		O(2)-Fe(1)-N(2)	160.50(9)
		O(3)-Fe(1)-N(1)	93.20(9)
		O(3)-Fe(1)-N(2)	99.88(9)
		O(4)-Fe(1)-N(1)	153.00(8)
		O(4)-Fe(1)-N(2)	94.50(8)
14
Fe(1)-O(1)	2.099(3)	C(1)-N(1)-Fe(1)	163.1(4)
Fe(1)-O(2)	2.312(3)	N(1)-C(1)-S(1)	178.2(4)
Fe(1)-N(1)	2.045(4)	O(1)-Fe(1)-O(2)	58.7(1)
S(1)-C(1)	1.643(6)	O(1)-Fe(1)-O(2A)	95.3(1)
C(1)-N(1)	1.139(6)	O(1)-Fe(1)-O(1A)	146.5(2)
	2.202(2)	O(2)-Fe(1)-O(2A)	84.2(2)
		N(1)-Fe(1)-O(1)	101.2(1)
		N(1)-Fe(1)-O(1A)	98.91(12)
		N(1)-Fe(1)-O(2)	89.14(13)
		N(1)-Fe(1)-N(1A)	105.8(2)
15
Fe(1)-O(1)	2.117(2)	O(1)-Fe(1)-O(2)	58.82(6)
Fe(1)-O(2)	2.315(2)	O(1)-Fe(1)-O(3)	93.52(7)
Fe(1)-O(3)	2.222(2)	O(1)-Fe(1)-O(4)	146.82(7)
Fe(1)-O(4)	2.1482)	O(3)-Fe(1)-O(4)	60.12(7)
Fe(1)-N(1)	2.095(2)	O(2)-Fe(1)-O(4)	97.30(7)
Fe(1)-N(1A)	2.099(2)	O(3)-Fe(1)-O(2)	86.93(7)
		O(1)-Fe(1)-N(1)	101.30(9)
		O(1)-Fe(1)-N(1A)	104.10(8)
		O(2)-Fe(1)-N(1)	90.34(8)
		O(2)-Fe(1)-N(1A)	162.79(8)
		O(3)-Fe(1)-N(1)	160.80(8)
		O(3)-Fe(1)-N(1A)	92.50(8)
		O(4)-Fe(1)-N(1)	101.50(8)
		O(4)-Fe(1)-N(1A)	97.30(8)

Atoms are labeled as indicated in Figure 5.