Crystallography Open Database

Information card for entry 2023049

2023048 << 2023049 >> 2023050

Preview

Coordinates	2023049.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	Tetraphenyl phosphate tetrakis[dimethyl (2,2,2-trichloroacetyl)phosphoramidato]lutetium(III)
Formula	C40 H44 Cl12 Lu N4 O16 P5
Calculated formula	C40 H44 Cl12 Lu N4 O16 P5
Title of publication	Crystal structure of tetra-phenyl phosphate tetra-kis-[dimethyl (2,2,2-tri-chloro-acet-yl)phos-pho-ramidato]lutetium(III), PPh<sub>4</sub>[Lu<i>L</i><sub>4</sub>].
Authors of publication	Struhatska, Mariia B.; Ovchynnikov, Vladimir A.; Kariaka, Nataliia S.; Gawryszewska, Paula; Amirkhanov, Volodymyr M.
Journal of publication	Acta crystallographica. Section E, Crystallographic communications
Year of publication	2024
Journal volume	80
Journal issue	Pt 4
Pages of publication	370 - 374
a	19.6882 ± 0.0003 Å
b	18.9452 ± 0.001 Å
c	17.2139 ± 0.0003 Å
α	90°
β	110.811 ± 0.0015°
γ	90°
Cell volume	6001.8 ± 0.4 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0445
Residual factor for significantly intense reflections	0.0401
Weighted residual factors for significantly intense reflections	0.1055
Weighted residual factors for all reflections included in the refinement	0.1077
Goodness-of-fit parameter for all reflections included in the refinement	1.084
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
291731 (current)	2024-05-06	cif/ Updating files of 2023049 Original log message: Adding full bibliography for 2023049.cif.	2023049.cif
290477	2024-03-13	cif/ Adding structures of 2023049 via cif-deposit CGI script.	2023049.cif