| Crystal data |
| Chemical formula |
C27H22N2O5·C4H8O2
|
C22H18N2O6·C2H6O |
C28H24N2O4
|
|
M
r
|
542.57 |
452.45 |
452.49 |
| Crystal system, space group |
Triclinic, P
|
Triclinic, P
|
Triclinic, P
|
| Temperature (K) |
293 |
293 |
293 |
|
a, b, c (Å) |
9.2210 (5), 12.1902 (8), 13.4982 (7) |
10.0964 (9), 10.1570 (8), 12.3628 (10) |
5.0681 (6), 13.4993 (15), 17.1144 (18) |
| α, β, γ (°) |
94.413 (5), 95.172 (4), 111.561 (5) |
84.557 (7), 68.169 (8), 82.529 (7) |
74.392 (9), 86.34 (1), 88.416 (10) |
|
V (Å3) |
1395.40 (15) |
1165.39 (18) |
1125.4 (2) |
|
Z
|
2 |
2 |
2 |
| Radiation type |
Cu Kα |
Cu Kα |
Cu Kα |
| μ (mm−1) |
0.76 |
0.80 |
0.73 |
| Crystal size (mm) |
0.12 × 0.1 × 0.02 |
0.18 × 0.16 × 0.04 |
0.17 × 0.04 × 0.03 |
| |
| Data collection |
| Diffractometer |
ROD, Synergy Custom system, HyPix-Arc 150 |
ROD, Synergy Custom system, HyPix-Arc 150 |
ROD, Synergy Custom system, HyPix-Arc 150 |
| Absorption correction |
Multi-scan (CrysAlis PRO; Rigaku OD, 2022 ▸) |
Multi-scan (CrysAlis PRO; Rigaku OD, 2022 ▸) |
Multi-scan (CrysAlis PRO; Rigaku OD, 2022 ▸) |
|
T
min, T
max
|
0.912, 1.000 |
0.660, 1.000 |
0.889, 1.000 |
| No. of measured, independent and observed [I > 2σ(I)] reflections |
15709, 5498, 3477 |
12522, 4585, 2642 |
11899, 4404, 1823 |
|
R
int
|
0.034 |
0.045 |
0.051 |
| (sin θ/λ)max (Å−1) |
0.629 |
0.637 |
0.631 |
| |
| Refinement |
|
R[F
2 > 2σ(F
2)], wR(F
2), S
|
0.062, 0.212, 1.09 |
0.086, 0.301, 1.07 |
0.077, 0.285, 0.99 |
| No. of reflections |
5498 |
4585 |
4404 |
| No. of parameters |
404 |
405 |
309 |
| No. of restraints |
60 |
136 |
6 |
| H-atom treatment |
H-atom parameters constrained |
H-atom parameters constrained |
H-atom parameters constrained |
| Δρmax, Δρmin (e Å−3) |
0.50, −0.25 |
0.45, −0.27 |
0.31, −0.24 |
