| Crystal data |
| Chemical formula |
C14H15N3
|
|
M
r
|
225.29 |
| Crystal system, space group |
Triclinic, P
|
| Temperature (K) |
293 |
|
a, b, c (Å) |
9.2429 (6), 11.1785 (8), 13.8791 (11) |
| α, β, γ (°) |
73.461 (7), 87.231 (6), 67.950 (6) |
|
V (Å3) |
1271.36 (17) |
|
Z
|
4 |
| Radiation type |
Mo Kα |
| μ (mm−1) |
0.07 |
| Crystal size (mm) |
0.27 × 0.23 × 0.12 |
| |
| Data collection |
| Diffractometer |
Xcalibur, Sapphire3 |
| Absorption correction |
Multi-scan (CrysAlis PRO; Rigaku OD, 2024 ▸) |
|
Tmin, Tmax
|
0.806, 1.000 |
| No. of measured, independent and observed [I > 2σ(I)] reflections |
9706, 4463, 2711 |
|
R
int
|
0.024 |
| (sin θ/λ)max (Å−1) |
0.595 |
| |
| Refinement |
|
R[F2 > 2σ(F2)], wR(F2), S
|
0.059, 0.190, 1.05 |
| No. of reflections |
4463 |
| No. of parameters |
324 |
| No. of restraints |
118 |
| H-atom treatment |
H-atom parameters constrained |
| Δρmax, Δρmin (e Å−3) |
0.32, −0.25 |
