| Crystal data |
| Chemical formula |
C9H11B10F7
|
|
M
r
|
360.28 |
| Crystal system, space group |
Orthorhombic, P212121
|
| Temperature (K) |
120 |
|
a, b, c (Å) |
6.7872 (2), 11.6926 (3), 19.4863 (5) |
|
V (Å3) |
1546.43 (7) |
|
Z
|
4 |
| Radiation type |
Mo Kα |
| μ (mm−1) |
0.14 |
| Crystal size (mm) |
0.30 × 0.21 × 0.10 |
| |
| Data collection |
| Diffractometer |
Rigaku Oxford Diffreaction SuperNova |
| Absorption correction |
Multi-scan (CrysAlis PRO; Rigaku OD, 2018 ▸) |
|
T
min, T
max
|
0.907, 1.000 |
| No. of measured, independent and observed [I > 2σ(I)] reflections |
40258, 5615, 5190 |
|
R
int
|
0.041 |
| (sin θ/λ)max (Å−1) |
0.768 |
| |
| Refinement |
|
R[F
2 > 2σ(F
2)], wR(F
2), S
|
0.039, 0.092, 1.15 |
| No. of reflections |
5615 |
| No. of parameters |
268 |
| H-atom treatment |
Only H-atom coordinates refined |
| Δρmax, Δρmin (e Å−3) |
0.32, −0.24 |
| Absolute structure |
Flack x determined using 1991 quotients [(I
+)−(I
−)]/[(I
+)+(I
−)] (Parsons et al., 2013 ▸) |
| Absolute structure parameter |
−0.03 (14) |
