Table 3. Experimental details.
Crystal data | |
Chemical formula | [Pd(C16H14N3S)2] |
M r | 667.12 |
Crystal system, space group | Monoclinic, P21/c |
Temperature (K) | 299 |
a, b, c (Å) | 15.084 (5), 11.418 (4), 17.097 (6) |
β (°) | 91.097 (9) |
V (Å3) | 2944.0 (16) |
Z | 4 |
Radiation type | Mo Kα |
μ (mm−1) | 0.81 |
Crystal size (mm) | 0.25 × 0.18 × 0.11 |
Data collection | |
Diffractometer | Bruker D8 Venture Photon 100 area detector diffractometer |
Absorption correction | Multi-scan (SADABS; Krause et al., 2015 ▸) |
T min, T max | 0.699, 0.746 |
No. of measured, independent and observed [I > 2σ(I)] reflections | 87933, 7344, 6204 |
R int | 0.042 |
(sin θ/λ)max (Å−1) | 0.668 |
Refinement | |
R[F 2 > 2σ(F 2)], wR(F 2), S | 0.026, 0.063, 1.05 |
No. of reflections | 7344 |
No. of parameters | 370 |
H-atom treatment | H-atom parameters constrained |
Δρmax, Δρmin (e Å−3) | 0.34, −0.50 |