Crystallography Open Database

Information card for entry 1566934

Preview

Coordinates	1566934.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	LAlCu
Formula	C41 H65 Al Cu N4 O0.5 P3
Calculated formula	C41 H65 Al Cu N4 O0.5 P3
Title of publication	One-electron bonds in copper-aluminum and copper-gallium complexes.
Authors of publication	Graziano, Brendan J.; Scott, Thais R.; Vollmer, Matthew V.; Dorantes, Michael J.; Young, Jr, Victor G; Bill, Eckhard; Gagliardi, Laura; Lu, Connie C.
Journal of publication	Chemical science
Year of publication	2022
Journal volume	13
Journal issue	22
Pages of publication	6525 - 6531
a	11.2148 ± 0.0007 Å
b	14.0921 ± 0.001 Å
c	14.3396 ± 0.0009 Å
α	70.906 ± 0.002°
β	82.68 ± 0.002°
γ	80.584 ± 0.002°
Cell volume	2106 ± 0.2 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.046
Residual factor for significantly intense reflections	0.0332
Weighted residual factors for significantly intense reflections	0.0842
Weighted residual factors for all reflections included in the refinement	0.0898
Goodness-of-fit parameter for all reflections included in the refinement	1.025
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
276601 (current)	2022-07-06	cif/ Updating files of 1566932, 1566933, 1566934, 1566935, 1566936, 1566937 Original log message: Adding full bibliography for 1566932--1566937.cif.	1566934.cif
275150	2022-05-07	cif/ Adding structures of 1566932, 1566933, 1566934, 1566935, 1566936, 1566937 via cif-deposit CGI script.	1566934.cif