| Crystal data |
| Chemical formula |
[Fe2(C8H12S3)(CO)6] |
|
M
r
|
484.12 |
| Crystal system, space group |
Triclinic, P
|
| Temperature (K) |
100 |
|
a, b, c () |
9.3619(10), 9.7681(11), 10.6249(12) |
| , , () |
88.092(6), 78.668(6), 76.559(6) |
|
V (3) |
926.51(18) |
|
Z
|
2 |
| Radiation type |
Mo K
|
| (mm1) |
1.93 |
| Crystal size (mm) |
0.27 0.13 0.05 |
| |
| Data collection |
| Diffractometer |
Bruker Kappa APEXII CCD |
| Absorption correction |
Integration (SADABS; Bruker, 2014 ▸) |
|
T
min, T
max
|
0.752, 0.935 |
| No. of measured, independent and observed [I > 2(I)] reflections |
26313, 4095, 3603 |
|
R
int
|
0.034 |
| (sin /)max (1) |
0.643 |
| |
| Refinement |
|
R[F
2 > 2(F
2)], wR(F
2), S
|
0.022, 0.055, 1.04 |
| No. of reflections |
4095 |
| No. of parameters |
230 |
| H-atom treatment |
H-atom parameters constrained |
|
max, min (e 3) |
0.46, 0.26 |
