| Crystal data |
| Chemical formula |
[Zn(HPO4)(C5H11NO2S)] |
|
M
r
|
310.56 |
| Crystal system, space group |
Orthorhombic, P212121
|
| Temperature (K) |
298 |
|
a, b, c () |
5.2210(2), 9.1889(4), 22.1559(10) |
|
V (3) |
1062.93(8) |
|
Z
|
4 |
| Radiation type |
Mo K
|
| (mm1) |
2.67 |
| Crystal size (mm) |
0.33 0.07 0.01 |
| |
| Data collection |
| Diffractometer |
BrukerNonius X8 APEX four-circle |
| Absorption correction |
Multi-scan (SADABS; Bruker, 2008 ▸) |
|
T
min, T
max
|
0.804, 0.974 |
| No. of measured, independent and observed [I > 2(I)] reflections |
7417, 2699, 2334 |
|
R
int
|
0.029 |
| (sin /)max (1) |
0.682 |
| |
| Refinement |
|
R[F
2 > 2(F
2)], wR(F
2), S
|
0.026, 0.056, 1.00 |
| No. of reflections |
2699 |
| No. of parameters |
144 |
| No. of restraints |
1 |
| H-atom treatment |
H atoms treated by a mixture of independent and constrained refinement |
|
max, min (e 3) |
0.39, 0.36 |
| Absolute structure |
Refined as an inversion twin |
| Absolute structure parameter |
0.055(16) |
