Facile Synthesis of Pyrazole- and Benzotriazole-Containing Selenoethers

Table 1

Crystallographic data, details of data collection, and structure refinement parameters for compounds 4 and 5.

Example	4	5
Chemical formula	C14H12N6Se	C14H22CuN6O6Se
M (g mol^−1)	343.26	512.88
Temperature (K)	100(2)	100(2)
Wavelength (Å)	0.71073	0.71073
Crystal size (mm)
Crystal system	Monoclinic	Monoclinic
Space group	P 21/c	P 21/c
(Å)	11.2605(8)	16.8873(9)
(Å)	9.1443(7)	8.3578(5)
(Å)	13.6312(10)	13.9597(8)
(°)	90	90
(°)	102.2002(13)	103.2610(10)
(°)	90	90
(Å^3)	1371.90(18)	1917.74(19)
	4	4
(g cm^−3)	1.662	1.776
(mm^−1)	2.740	3.082
	688	1036
range for data; collection (°)	1.85 to 29.00	2.48 to 29.00
Index ranges
	Reflections collected	15771	22301
	Independent reflections	3651	5086
Completeness to (%)	99.9	99.7
Absorption correction	Semi-empirical from equivalents	Semi-empirical from equivalents
Max. and min. transmission	0.753 and 0.700	0.913 and 0.694
Data/restraints/parameters	3651/0/190	5086/0/257
Goodness-of-fit on	1.002	1.018
Final	=
	=
(all data)
	Largest difference in peak and hole (e Å^−3)	0.434 and −0.433	0.590 and −0.604