Reinvestigating the Reaction of 1H-Pyrazol-5-amines with 4,5-Dichloro-1,2,3-dithiazolium Chloride: A Route to Pyrazolo[3,4-c]isothiazoles and Pyrazolo[3,4-d]thiazoles.
Authors of publication
Koyioni, Maria; Manoli, Maria; Manolis, Manos J.; Koutentis, Panayiotis A.
Journal of publication
The Journal of organic chemistry
Year of publication
2014
Journal volume
79
Journal issue
9
Pages of publication
4025 - 4037
a
3.8592 ± 0.0003 Å
b
8.4044 ± 0.0011 Å
c
12.5408 ± 0.0016 Å
α
87.517 ± 0.01°
β
85.342 ± 0.009°
γ
81.578 ± 0.009°
Cell volume
400.83 ± 0.08 Å3
Cell temperature
100 ± 2 K
Ambient diffraction temperature
100 ± 2 K
Number of distinct elements
4
Space group number
2
Hermann-Mauguin space group symbol
P -1
Hall space group symbol
-P 1
Residual factor for all reflections
0.0604
Residual factor for significantly intense reflections
0.0508
Weighted residual factors for significantly intense reflections
0.1362
Weighted residual factors for all reflections included in the refinement
0.1434
Goodness-of-fit parameter for all reflections included in the refinement
