Three new [<i>X</i>C(O)NH]P(O)[N(CH~2~C~6~H~5~)~2~]~2~ phosphoric triamides (<i>X</i> = CClF~2~, 3-F-C~6~H~4~ and 3,5-F~2~-C~6~H~3~): a database analysis of tertiary N-atom geometry in compounds with a C(O)NHP(O)[N]~2~ core
Authors of publication
Pourayoubi, Mehrdad; Jasinski, Jerry P.; Shoghpour Bayraq, Samad; Eshghi, Hossein; Keeley, Amanda C.; Bruno, Giuseppe; Amiri Rudbari, Hadi
Journal of publication
Acta Crystallographica Section C
Year of publication
2012
Journal volume
68
Journal issue
10
Pages of publication
o399 - o404
a
10.8298 ± 0.0003 Å
b
9.9164 ± 0.0003 Å
c
26.674 ± 0.0008 Å
α
90°
β
91.539 ± 0.001°
γ
90°
Cell volume
2863.56 ± 0.15 Å3
Cell temperature
296 ± 2 K
Ambient diffraction temperature
296 ± 2 K
Number of distinct elements
7
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
0.0533
Residual factor for significantly intense reflections
0.0455
Weighted residual factors for significantly intense reflections
0.1246
Weighted residual factors for all reflections included in the refinement
0.1339
Goodness-of-fit parameter for all reflections included in the refinement