| Crystal data |
| Chemical formula |
[Zn(C14H14NO4)2(H2O)2]·2C2H6OS |
|
M
r
|
778.18 |
| Crystal system, space group |
Monoclinic, P21/n
|
| Temperature (K) |
90 |
|
a, b, c (Å) |
5.2704 (2), 20.2885 (8), 16.0314 (8) |
| β (°) |
94.210 (2) |
|
V (Å3) |
1709.59 (13) |
|
Z
|
2 |
| Radiation type |
Mo Kα |
| μ (mm−1) |
0.91 |
| Crystal size (mm) |
0.42 × 0.13 × 0.06 |
| |
| Data collection |
| Diffractometer |
Bruker Kappa APEXII CCD DUO |
| Absorption correction |
Multi-scan (SADABS; Sheldrick, 2004 ▸) |
|
T
min, T
max
|
0.839, 0.948 |
| No. of measured, independent and observed [I > 2σ(I)] reflections |
52833, 7923, 6800 |
|
R
int
|
0.034 |
| (sin θ/λ)max (Å−1) |
0.821 |
| |
| Refinement |
|
R[F
2 > 2σ(F
2)], wR(F
2), S
|
0.029, 0.074, 1.05 |
| No. of reflections |
7923 |
| No. of parameters |
233 |
| No. of restraints |
2 |
| H-atom treatment |
H atoms treated by a mixture of independent and constrained refinement |
| Δρmax, Δρmin (e Å−3) |
0.64, −0.29 |
