Synthesis, Characterization, and DNA-Binding Kinetics of New Pd(II) and Pt(II) Thiosemicarbazone Complexes: Spectral, Structural, and Anticancer Evaluation

Table 2

Crystal data for L1.

Chemical formula	C6H7N3S2
Mr	185.27
Crystal system, space group	Monoclinic, P21/n
Temperature (K)	100
a, b, c (Å)	13.4381 (2), 5.7728 (1), 21.2683 (4)
β (°)	96.302 (1)
V (Å^3)	1639.93 (5)
Z	8
Radiation type	Cu Kα
µ (mm^−1)	5.37
Crystal size (mm)	0.37 × 0.23 × 0.19
Data collection
Diffractometer	Bruker SMART CCD Apex-II area-detector
Tmin, Tmax	0.272, 0.496
No. of measured, independent, and observed (I > 2σ(I)) reflections	21136, 2897, 2744
R int	0.041
(sin θ/λ)max (Å^−1)	0.596
Refinement
R[F^2 > 2σ(F^2)], wR(F^2), S	0.026, 0.067, 1.04
No. of reflections	2897
No. of parameters	200
H-atom treatment	H-atom parameters constrained
Δρmax, Δρmin (e Å^−3)	0.37, −0.27