Inhaltsverzeichnis - Anorganische Chemie
Inhaltsverzeichnis - Anorganische Chemie
Inhaltsverzeichnis - Anorganische Chemie
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89<br />
Table 46: Atomic coordinates ( x 10 4 ) and equivalent isotropic displacement parameters<br />
(Å 2 x 10 3 ) for fn153 . U(eq) is defined as one third of the trace of the orthogonalized U ij<br />
tensor.<br />
_____________________________________________________________<br />
x y z U(eq)<br />
_____________________________________________________________<br />
Fe(1) 4334.6(9) 2500 -229.5(5) 24.9(1)<br />
Cl(11) 2574.9(12) 1218.5(5) -834.1(6) 32.8(1)<br />
Cl(21) 4691(2) 2500 1578.3(9) 42.5(3)<br />
Cl(31) 7565.3(17) 2500 -666.7(10) 36.6(3)<br />
Fe(2) 2423.0(9) 2500 4826.6(4) 22.3(1)<br />
Cl(12) -1122.4(15) 2500 4433.8(9) 30.3(2)<br />
Cl(22) 3533.0(18) 2500 6625.5(8) 33.2(2)<br />
Cl(32) 3622.5(12) 1222.2(5) 4142.6(6) 33.1(1)<br />
S(1) 2729.8(13) 4952.8(5) 1453.6(6) 34.4(2)<br />
S(2) 134.2(14) 4048.1(5) 1409.9(7) 39.0(2)<br />
N(1) -1297(4) 4225.6(19) 2310(2) 37.4(6)<br />
S(3) -1644.6(12) 4805.3(6) 3357.1(7) 36.8(2)<br />
N(2) -39(4) 5610.7(17) 3751(2) 31.8(6)<br />
S(4) 2033.9(12) 6079.9(5) 3422.9(6) 31.6(1)<br />
N(3) 2960(4) 5666.7(16) 2402(2) 28.6(5)<br />
Table 47: Bond lengths [Å] and angles [°] for fn153 .<br />
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Fe(1)-Cl(31) 2.1761(12) Fe(1)-Cl(21) 2.1809(12)<br />
Fe(1)-Cl(11) 2.2188(7) Fe(1)-Cl(11A) 2.2188(7)<br />
Fe(2)-Cl(22) 2.1904(11) Fe(2)-Cl(12) 2.1918(11)<br />
Fe(2)-Cl(32A) 2.2101(7) Fe(2)-Cl(32) 2.2101(7)<br />
S(1)-N(3) 1.540(2) S(1)-S(2) 2.0802(12)<br />
S(2)-N(1) 1.550(3) N(1)-S(3) 1.574(3)<br />
S(3)-N(2) 1.562(3) N(2)-S(4) 1.574(3)<br />
S(4)-N(3) 1.577(3)<br />
Cl(31)-Fe(1)-Cl(21) 107.77(5) Cl(31)-Fe(1)-Cl(11) 110.42(3)<br />
Cl(21)-Fe(1)-Cl(11) 107.35(3) Cl(31)-Fe(1)-Cl(11A) 110.42(3)<br />
Cl(21)-Fe(1)-Cl(11A) 107.35(3) Cl(11)-Fe(1)-Cl(11A) 113.29(5)<br />
Cl(22)-Fe(2)-Cl(12) 111.12(5) Cl(22)-Fe(2)-Cl(32A) 107.92(3)<br />
Cl(12)-Fe(2)-Cl(32A) 108.23(3) Cl(22)-Fe(2)-Cl(32) 107.92(3)<br />
Cl(12)-Fe(2)-Cl(32) 108.23(3) Cl(32A)-Fe(2)-Cl(32) 113.47(5)<br />
N(3)-S(1)-S(2) 114.58(10) N(1)-S(2)-S(1) 114.76(11)<br />
S(2)-N(1)-S(3) 146.95(18) N(2)-S(3)-N(1) 118.61(14)<br />
S(3)-N(2)-S(4) 139.36(17) N(2)-S(4)-N(3) 117.71(13)<br />
S(1)-N(3)-S(4) 147.94(17)<br />
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Symmetry operations used for equivalent atoms :<br />
A : x, -y+1/2, z<br />
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