| Crystal data |
| Chemical formula |
[Fe2(C5H5)2(C23H17ClN2)] |
|
M
r
|
671.81 |
| Crystal system, space group |
Triclinic, P
|
| Temperature (K) |
150 |
|
a, b, c (Å) |
8.0175 (10), 11.3134 (14), 17.408 (2) |
| α, β, γ (°) |
95.099 (2), 99.963 (2), 96.414 (2) |
|
V (Å3) |
1536.0 (3) |
|
Z
|
2 |
| Radiation type |
Mo Kα |
| μ (mm−1) |
1.07 |
| Crystal size (mm) |
0.35 × 0.30 × 0.03 |
| |
| Data collection |
| Diffractometer |
Bruker D8 QUEST PHOTON 3 diffractometer |
| Absorption correction |
Numerical (SADABS; Krause et al., 2015 ▸) |
|
T
min, T
max
|
0.71, 0.96 |
| No. of measured, independent and observed [I > 2σ(I)] reflections |
19205, 9949, 7143 |
|
R
int
|
0.034 |
| (sin θ/λ)max (Å−1) |
0.737 |
| |
| Refinement |
|
R[F
2 > 2σ(F
2)], wR(F
2), S
|
0.047, 0.131, 1.03 |
| No. of reflections |
9949 |
| No. of parameters |
396 |
| No. of restraints |
2 |
| H-atom treatment |
H atoms treated by a mixture of independent and constrained refinement |
| Δρmax, Δρmin (e Å−3) |
0.54, −0.85 |
