| Crystal data |
| Chemical formula |
[Cu(C4F7O2)2(C12H8N2)(H2O)] |
|
M
r
|
687.84 |
| Crystal system, space group |
Monoclinic, C2/c
|
| Temperature (K) |
110 |
|
a, b, c (Å) |
18.0213 (5), 19.4619 (6), 13.8664 (4) |
| β (°) |
102.205 (1) |
|
V (Å3) |
4753.4 (2) |
|
Z
|
8 |
| Radiation type |
Mo Kα |
| μ (mm−1) |
1.07 |
| Crystal size (mm) |
0.35 × 0.26 × 0.20 |
| |
| Data collection |
| Diffractometer |
Bruker APEXII CCD area-detector |
| Absorption correction |
Multi-scan (SADABS; Bruker, 2004 ▸) |
|
T
min, T
max
|
0.707, 0.815 |
| No. of measured, independent and observed [I > 2σ(I)] reflections |
22348, 5892, 4467 |
|
R
int
|
0.030 |
| (sin θ/λ)max (Å−1) |
0.668 |
| |
| Refinement |
|
R[F
2 > 2σ(F
2)], wR(F
2), S
|
0.056, 0.156, 0.95 |
| No. of reflections |
5892 |
| No. of parameters |
450 |
| No. of restraints |
21 |
| H-atom treatment |
H atoms treated by a mixture of independent and constrained refinement |
| Δρmax, Δρmin (e Å−3) |
1.59, −1.08 |
