| Crystal data |
| Chemical formula |
C10H13NO2S |
|
M
r
|
211.27 |
| Crystal system, space group |
Triclinic, P
|
| Temperature (K) |
173 |
|
a, b, c (Å) |
7.5538 (10), 8.2591 (11), 9.7145 (13) |
| α, β, γ (°) |
85.9415 (16), 72.9167 (16), 67.6989 (15) |
|
V (Å3) |
535.42 (12) |
|
Z
|
2 |
| Radiation type |
Mo Kα |
| μ (mm−1) |
0.28 |
| Crystal size (mm) |
0.28 × 0.25 × 0.20 |
| |
| Data collection |
| Diffractometer |
Bruker APEXII CCD |
| Absorption correction |
Multi-scan (SADABS; Bruker, 2014 ▸) |
|
T
min, T
max
|
0.672, 0.745 |
| No. of measured, independent and observed [I > 2σ(I)] reflections |
6472, 1963, 1564 |
|
R
int
|
0.036 |
| (sin θ/λ)max (Å−1) |
0.604 |
| |
| Refinement |
|
R[F
2 > 2σ(F
2)], wR(F
2), S
|
0.053, 0.156, 1.09 |
| No. of reflections |
1963 |
| No. of parameters |
132 |
| No. of restraints |
1 |
| H-atom treatment |
H atoms treated by a mixture of independent and constrained refinement |
| Δρmax, Δρmin (e Å−3) |
0.60, −0.26 |
