Crystallography Open Database

Information card for entry 7717146

Preview

Coordinates	7717146.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H58 Mg2 N6
Calculated formula	C40 H58 Mg2 N6
Title of publication	Synthesis and Reactivity of a Heteroleptic Magnesium Hydride on a Dearomatized Picolyl-Based NNN-Chelator.
Authors of publication	Mandal, Chhotan; Sarkar, Subham; Panda, Sourav; Mallick, Dibyendu; Mukherjee, Debabrata
Journal of publication	Dalton Transactions
Year of publication	2024
a	14.1364 ± 0.0002 Å
b	15.1179 ± 0.0002 Å
c	18.5001 ± 0.0002 Å
α	90°
β	90°
γ	90°
Cell volume	3953.71 ± 0.09 Å³
Cell temperature	99.97 ± 0.19 K
Ambient diffraction temperature	100.15 K
Number of distinct elements	4
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0383
Residual factor for significantly intense reflections	0.0341
Weighted residual factors for significantly intense reflections	0.0812
Weighted residual factors for all reflections included in the refinement	0.0834
Goodness-of-fit parameter for all reflections included in the refinement	1.0804
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7717146.html