Crystallography Open Database

Information card for entry 7134583

Preview

Coordinates	7134583.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H60 K Li N4 O P2
Calculated formula	C40 H60 K Li N4 O P2
Title of publication	[(TMEDA)Li(μ-PPh2)2K(TMEDA)(THF)]: a heterobimetallic molecular lithium–potassium phosphide complex
Authors of publication	Crabbe, Michelle H.; O’Meara, Danielle; Kennedy, Alan R.; Weetman, Catherine E.; Mulvey, Robert E.
Journal of publication	Chemical Communications
Year of publication	2025
Journal volume	61
Journal issue	52
Pages of publication	9436 - 9439
a	12.0377 ± 0.0001 Å
b	12.2718 ± 0.0001 Å
c	14.9623 ± 0.0001 Å
α	90.125 ± 0.001°
β	107.078 ± 0.001°
γ	100.987 ± 0.001°
Cell volume	2070.12 ± 0.03 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	0.04
Residual factor for significantly intense reflections	0.0391
Weighted residual factors for significantly intense reflections	0.1085
Weighted residual factors for all reflections included in the refinement	0.1093
Goodness-of-fit parameter for all reflections included in the refinement	1.03
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
300452 (current)	2025-07-06	cif/ Updating files of 7134583 Original log message: Adding full bibliography for 7134583.cif.	7134583.cif
299785	2025-05-23	cif/ Adding structures of 7134583 via cif-deposit CGI script.	7134583.cif