| Crystal data |
| Chemical formula |
C6H13NO2
|
|
M
r
|
131.17 |
| Crystal system, space group |
Monoclinic, P21
|
| Temperature (K) |
100 |
|
a, b, c (Å) |
9.6757 (5), 5.2885 (3), 28.0136 (15) |
| β (°) |
98.300 (3) |
|
V (Å3) |
1418.44 (13) |
|
Z
|
8 |
| Radiation type |
Mo Kα |
| μ (mm−1) |
0.09 |
| Crystal size (mm) |
0.50 × 0.20 × 0.15 |
| |
| Data collection |
| Diffractometer |
Bruker APEXII KappaCCD |
| Absorption correction |
Multi-scan (SADABS; Bruker, 2015 ▸) |
|
T
min, T
max
|
0.956, 0.987 |
| No. of measured, independent and observed [I > 2σ(I)] reflections |
44938, 7935, 7188 |
|
R
int
|
0.060 |
| (sin θ/λ)max (Å−1) |
0.694 |
| |
| Refinement |
|
R[F
2 > 2σ(F
2)], wR(F
2), S
|
0.077, 0.211, 1.15 |
| No. of reflections |
7935 |
| No. of parameters |
338 |
| No. of restraints |
7 |
| H-atom treatment |
H-atom parameters constrained |
| Δρmax, Δρmin (e Å−3) |
0.58, −0.42 |
| Absolute structure |
Flack x determined using 2758 quotients [(I
+)−(I
−)]/[(I
+)+(I
−)] (Parsons et al., 2013 ▸) |
| Absolute structure parameter |
−0.2 (4) |
