Crystallography Open Database

Information card for entry 8102162

Preview

Coordinates	8102162.cif

Structure parameters

Chemical name	N,N'-dibenzyl-N,N'-dimethyl-N"-(2-fluorobenzoyl)phosphoric diamide
Formula	C23 H25 F N3 O2 P
Calculated formula	C23 H25 F N3 O2 P
Title of publication	Crystal structure of N,N'-dibenzyl-N,N'-dimethyl-N"-(2-fluorobenzoyl) phosphoric diamide, C~23~H~25~FN~3~O~2~P
Authors of publication	Mahmoudi, Ali; Hadjikhani, Ramin
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2007
Journal volume	222
Journal issue	3
Pages of publication	313 - 314
a	10.1979 ± 0.0006 Å
b	10.8417 ± 0.0006 Å
c	11.5399 ± 0.0012 Å
α	101.789 ± 0.001°
β	95.45 ± 0.001°
γ	117.947 ± 0.001°
Cell volume	1076.15 ± 0.14 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.045
Residual factor for significantly intense reflections	0.0371
Weighted residual factors for significantly intense reflections	0.0966
Weighted residual factors for all reflections included in the refinement	0.1034
Goodness-of-fit parameter for all reflections included in the refinement	1.029
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
176728 (current)	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 8.	8102162.cif
108388	2014-03-31	cif/8/ (antanas@lokys.ibt.lt) Adding and updating bibliographic information: volume, authors, issue, first page, last page.	8102162.cif
35911	2012-02-28	cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree.	8102162.cif
12901	2011-03-06	../uploads/cif-deposit/cod/cif Adding structures of 8102162 via cif-deposit CGI script.	8102162.cif