| Crystal data |
| Chemical formula |
[Co(C2H8N2)3]I3(I)2
|
|
M
r
|
873.74 |
| Crystal system, space group |
Orthorhombic, P212121
|
| Temperature (K) |
120 |
|
a, b, c (Å) |
8.7508 (12), 8.8333 (12), 25.982 (4) |
|
V (Å3) |
2008.4 (5) |
|
Z
|
4 |
| Radiation type |
Mo Kα |
| μ (mm−1) |
8.54 |
| Crystal size (mm) |
0.28 × 0.15 × 0.10 |
| |
| Data collection |
| Diffractometer |
Bruker Kappa X8 APEXII |
| Absorption correction |
Numerical (SADABS; Krause et al., 2015 ▸) |
|
T
min, T
max
|
0.603, 1.000 |
| No. of measured, independent and observed [I > 2σ(I)] reflections |
35617, 5024, 5023 |
|
R
int
|
0.022 |
| (sin θ/λ)max (Å−1) |
0.668 |
| |
| Refinement |
|
R[F
2 > 2σ(F
2)], wR(F
2), S
|
0.012, 0.028, 1.33 |
| No. of reflections |
5024 |
| No. of parameters |
199 |
| H-atom treatment |
H atoms treated by a mixture of independent and constrained refinement |
| Δρmax, Δρmin (e Å−3) |
0.39, −0.66 |
| Absolute structure |
Flack x determined using 2136 quotients [(I
+)−(I
−)]/[(I
+)+(I
−)] (Parsons et al., 2013 ▸). |
| Absolute structure parameter |
0.017 (9) |
