Table 1.

Crystallographic Data for Complex 5

empirical formula	C10H17BrO5PReS2
fw	578.44
temp	173(2) K
wavelength	0.71073 Å
cryst syst, space group	triclinic, P1̄
unit cell dimensions	a = 6.5967(4) Å, α = 89.0590(10)°, b = 8.9236(5) Å, β = 79.3080(10)°, c = 14.1771(8) Å, γ = 87.8210(10)°
volume	819.43(8) Å3
Z, calcd density	2, 2.344 Mg/m3
abs coeff	10.217 mm−1
F(000)	548
cryst size	0.45 × 0.15 × 0.15 mm
θ range for data collection	2.28–27.11°
limiting indices	−8 ≤ h ≤ 7, −11 ≤ k ≤ 11, −18 ≤ l ≤ 12
reflns collected/unique	5882/3538 [R(int) = 0.0346]
completeness to θ = 27.11	97.50%
abs correction	semiempirical from equivalents
max and min transm	0.26 and 0.08
refinement method	full-matrix least-squares on F2
data/restraints/params	3538/0/183
GOF on F2	1.082
final R indices [I > 2σ(I)]	R1 = 0.0549, wR2 = 0.1520
R indices (all data)	R1 = 0.0590, wR2 = 0.1554
extinction coefficient	0.0007(8)
largest diff. peak and hole	3.364 and −4.033 e.A-3