C 23 H 22 N 13 Br, triclinic, P1 (no. 2), a = 9.255(6) Å, b = 9.819(6) Å, c = 14.497(9) Å, α = 105.186(7)°, β = 90.030(7)°, γ = 102.228(7)°, V = 1240.3(13) Å 3 , Z = 2, R gt (F) = 0.0434,
CCDC no.: 1587469The asymmetric unit of the title crystal structure is shown in the figure. Tables 1 and 2 contain details on crystal structure and measurement conditions and a list of the atoms including atomic coordinates and displacement parameters.
Source of materialA mixture of 2,6-bis(3-(pyrazin-2-yl)-1H-1,2,4-triazol-5-yl) pyridine (0.05 mmol) and [EMI]Br ionic liquid (EMI = 1-elkyl-3-methylimidazolium) (1 g) in 10 mL mixed solvent (CH 3 CN/H 2 O, V/V, 7:3) was placed in a 25 mL Teflon-lined stainless steel vessel, and the vessel was sealed and heated to 160°C for 72 h. After the mixture had been cooled to room temperature, colorless crystals of the title complex were obtained.