Crystallography Open Database

Information card for entry 7233343

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Coordinates	7233343.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C19 H23 F4 N2 O3 P
Calculated formula	C19 H23 F4 N2 O3 P
Title of publication	Synthesis, structural studies and biological properties of some phosphono-perfluorophenylalanine derivatives formed by SNAr reactions
Authors of publication	Kwiczak-Yiğitbaşı, Joanna; Pirat, Jean-Luc; Virieux, David; Volle, Jean-Noël; Janiak, Agnieszka; Hoffmann, Marcin; Mrzygłód, Jakub; Wawrzyniak, Dariusz; Barciszewski, Jan; Pluskota-Karwatka, Donata
Journal of publication	RSC Advances
Year of publication	2019
Journal volume	9
Journal issue	42
Pages of publication	24117
a	11.7691 ± 0.0009 Å
b	12.2935 ± 0.0005 Å
c	16.8735 ± 0.0009 Å
α	101.12 ± 0.004°
β	99.04 ± 0.005°
γ	118.147 ± 0.006°
Cell volume	2023.5 ± 0.3 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	0.0798
Residual factor for significantly intense reflections	0.0527
Weighted residual factors for significantly intense reflections	0.1145
Weighted residual factors for all reflections included in the refinement	0.1311
Goodness-of-fit parameter for all reflections included in the refinement	1.028
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
217423 (current)	2019-08-06	cif/ Adding structures of 7233342, 7233343 via cif-deposit CGI script.	7233343.cif