Table 4.
Atom | CNa | R (Å)b | σ2 × 103c | F′ | |
---|---|---|---|---|---|
A | S | 4 | 2.26 | 7.6 | 0.669 |
Fe | 1 | 2.67 | 3.9 | ||
B | S | 2 | 2.24 | 3.7 | 0.454 |
S | 2 | 2.33 | 11.2 | ||
Fe | 1 | 2.68 | 4.8 | ||
C | S | 2 | 2.26 | 4.4 | 0.296 |
N | 2 | 2.06 | 4.6 | ||
Fe | 1 | 2.67 | 4.6 | ||
D | S | 3 | 2.26 | 5.2 | 0.350 |
imidazoled | 1 | 2.05 | 2.1 | ||
Fe | 1 | 2.68 | 3.4 |
CN = coordination number
R = metal-scatterer distance
σ2 = Mean square variation in R
multiple scattering paths of imidazole ring are included