| Crystal data |
| Chemical formula |
[FeCl2(C42H28O4P2)2]·2CH2Cl2
|
|
M
r
|
1613.77 |
| Crystal system, space group |
Tetragonal, P43212 |
| Temperature (K) |
150 |
|
a, c (Å) |
11.9850 (3), 52.4508 (14) |
|
V (Å3) |
7534.0 (4) |
|
Z
|
4 |
| Radiation type |
Cu Kα |
| μ (mm−1) |
4.84 |
| Crystal size (mm) |
0.09 × 0.04 × 0.02 |
| |
| Data collection |
| Diffractometer |
Bruker Kappa APEX DUO CCD |
| Absorption correction |
Multi-scan (SADABS; Krause et al., 2015 ▸) |
|
T
min, T
max
|
0.649, 0.740 |
| No. of measured, independent and observed [I > 2σ(I)] reflections |
97444, 6829, 6096 |
|
R
int
|
0.109 |
| (sin θ/λ)max (Å−1) |
0.600 |
| |
| Refinement |
|
R[F
2 > 2σ(F
2)], wR(F
2), S
|
0.043, 0.110, 1.04 |
| No. of reflections |
6829 |
| No. of parameters |
502 |
| No. of restraints |
51 |
| H-atom treatment |
H-atom parameters constrained |
| Δρmax, Δρmin (e Å−3) |
0.39, −0.65 |
| Absolute structure |
Flack x determined using 2237 quotients [(I
+)−(I
−)]/[(I
+)+(I
−)] (Parsons et al., 2013 ▸) |
| Absolute structure parameter |
0.004 (4) |
