Low-temperature crystallization and structure determination of <i>N</i>-(trifluoromethyl)formamide, <i>N</i>-(2,2,2-trifluoroethyl)formamide and 2,2,2-trifluoroethyl isocyanide
Authors of publication
Perpetuo, Genivaldo; Buschmann, Jürgen; Luger, Peter; Lentz, Dieter; Dreissig, D.
Journal of publication
Acta Crystallographica Section B
Year of publication
1999
Journal volume
55
Journal issue
1
Pages of publication
70 - 77
a
4.807 ± 0.001 Å
b
16.707 ± 0.003 Å
c
6.708 ± 0.001 Å
α
90°
β
109.9 ± 0.01°
γ
90°
Cell volume
506.55 ± 0.16 Å3
Cell temperature
141 ± 1 K
Ambient diffraction temperature
141 ± 1 K
Number of distinct elements
5
Space group number
14
Hermann-Mauguin space group symbol
P 1 21/n 1
Hall space group symbol
-P 2yn
Residual factor for all reflections
0.0783
Residual factor for significantly intense reflections
0.0508
Weighted residual factors for all reflections
0.1402
Weighted residual factors for significantly intense reflections
0.1619
Goodness-of-fit parameter for all reflections
1.085
Goodness-of-fit parameter for significantly intense reflections
