Crystallography Open Database

Information card for entry 7128206

Preview

Coordinates	7128206.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C44 H70 Li N4 P7 Si2
Calculated formula	C44 H70 Li N4 P7 Si2
Title of publication	Fragmentation, catenation, and direct functionalisation of white phosphorus by a uranium(IV)-silyl-phosphino-carbene complex.
Authors of publication	Boronski, Josef T.; Seed, John A.; Wooles, Ashley J.; Liddle, Stephen T.
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2021
Journal volume	57
Journal issue	41
Pages of publication	5090 - 5093
a	9.9343 ± 0.0004 Å
b	23.4616 ± 0.0011 Å
c	22.0737 ± 0.0012 Å
α	90°
β	91.875 ± 0.005°
γ	90°
Cell volume	5142.1 ± 0.4 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
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	0.0993
Residual factor for significantly intense reflections	0.0686
Weighted residual factors for significantly intense reflections	0.1798
Weighted residual factors for all reflections included in the refinement	0.201
Goodness-of-fit parameter for all reflections included in the refinement	1.04
Diffraction radiation probe	x-ray
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
265854 (current)	2021-06-05	cif/ Updating files of 7128206, 7128207, 7128208 Original log message: Adding full bibliography for 7128206--7128208.cif.	7128206.cif
264343	2021-04-21	cif/ Adding structures of 7128206, 7128207, 7128208 via cif-deposit CGI script.	7128206.cif