| Crystal data |
| Chemical formula |
C21H18
|
C30H24O2
|
|
M
r
|
270.35 |
416.49 |
| Crystal system, space group |
Orthorhombic, P
b
c
a
|
Orthorhombic, P212121
|
| Temperature (K) |
100 |
100 |
|
a, b, c (Å) |
12.9844 (2), 11.9583 (1), 19.3729 (2) |
7.3431 (1), 11.5468 (1), 25.7555 (3) |
|
V (Å3) |
3008.06 (6) |
2183.79 (4) |
|
Z
|
8 |
4 |
| Radiation type |
Mo Kα |
Mo Kα |
| μ (mm−1) |
0.07 |
0.08 |
| Crystal size (mm) |
0.38 × 0.25 × 0.15 |
0.27 × 0.15 × 0.13 |
| |
| Data collection |
| Diffractometer |
XtaLAB Synergy, Single source at offset/far, HyPix3000 |
XtaLAB Synergy, Single source at offset/far, HyPix3000 |
| Absorption correction |
Empirical (using intensity measurements) (CrysAlis PRO; Rigaku OD, 2019 ▸) |
Empirical (using intensity measurements) (CrysAlis PRO; Rigaku OD, 2019 ▸) |
|
T
min, T
max
|
0.404, 1.000 |
0.735, 1.000 |
| No. of measured, independent and observed [I > 2σ(I)] reflections |
74031, 3353, 2967 |
54562, 4798, 4437 |
|
R
int
|
0.030 |
0.036 |
| (sin θ/λ)max (Å−1) |
0.648 |
0.647 |
| |
| Refinement |
|
R[F
2 > 2σ(F
2)], wR(F
2), S
|
0.036, 0.094, 1.08 |
0.034, 0.082, 1.04 |
| No. of reflections |
3353 |
4798 |
| No. of parameters |
190 |
291 |
| H-atom treatment |
H-atom parameters constrained |
H-atom parameters constrained |
| Δρmax, Δρmin (e Å−3) |
0.20, −0.19 |
0.16, −0.19 |
| Absolute structure |
– |
Flack x determined using 1774 quotients [(I
+)−(I
−)]/[(I
+)+(I
−)] (Parsons et al., 2013 ▸) |
| Absolute structure parameter |
– |
−0.3 (4) |
