| Crystal data |
| Chemical formula |
[Fe(SO4)(C5H5N)4] |
[Co3(SO4)3(C5H5N)11] |
|
M
r
|
468.31 |
1335.07 |
| Crystal system, space group |
Monoclinic, I2/a
|
Orthorhombic, P212121
|
| Temperature (K) |
200 |
200 |
|
a, b, c (Å) |
11.8259 (10), 10.0847 (9), 17.264 (2) |
9.4583 (5), 18.0344 (12), 33.088 (2) |
| α, β, γ (°) |
90, 102.569 (2), 90 |
90, 90, 90 |
|
V (Å3) |
2009.6 (3) |
5644.0 (6) |
|
Z
|
4 |
4 |
| Radiation type |
Mo Kα |
Mo Kα |
| μ (mm−1) |
0.89 |
1.06 |
| Crystal size (mm) |
0.28 × 0.20 × 0.20 |
0.24 × 0.22 × 0.20 |
| |
| Data collection |
| Diffractometer |
Bruker D8 Venture CMOS |
Bruker D8 Venture CMOS |
| Absorption correction |
Multi-scan (SADABS; Bruker, 2016 ▸) |
Multi-scan (SADABS; Bruker, 2016 ▸) |
|
T
min, T
max
|
0.397, 0.429 |
0.394, 0.429 |
| No. of measured, independent and observed [I > 2σ(I)] reflections |
25476, 1917, 1760 |
80759, 10744, 9925 |
|
R
int
|
0.029 |
0.037 |
| (sin θ/λ)max (Å−1) |
0.612 |
0.612 |
| |
| Refinement |
|
R[F
2 > 2σ(F
2)], wR(F
2), S
|
0.021, 0.057, 1.08 |
0.024, 0.052, 1.04 |
| No. of reflections |
1917 |
10744 |
| No. of parameters |
139 |
758 |
| H-atom treatment |
H-atom parameters constrained |
H-atom parameters constrained |
| Δρmax, Δρmin (e Å−3) |
0.30, −0.34 |
0.27, −0.25 |
| Absolute structure |
– |
Flack x determined using 4178 quotients [(I
+)−(I
−)]/[(I
+)+(I
−)] (Parsons et al, 2013 ▸) |
| Absolute structure parameter |
– |
0.003 (3) |
