Crystallography Open Database

Information card for entry 1569359

Preview

Coordinates	1569359.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C44 H48 N2 Ni O
Calculated formula	C44 H48 N2 Ni O
Title of publication	Facile access to diverse polyethylenes via neutral salicylaldiminato nickel catalysts
Authors of publication	Li, Qiankun; Mu, Hongliang; Jian, Zhongbao
Journal of publication	Polymer Chemistry
Year of publication	2023
Journal volume	14
Journal issue	27
Pages of publication	3196 - 3202
a	14.0027 ± 0.001 Å
b	15.4287 ± 0.0013 Å
c	20.8968 ± 0.0018 Å
α	102.072 ± 0.003°
β	104.783 ± 0.002°
γ	108.198 ± 0.002°
Cell volume	3936.5 ± 0.6 Å³
Cell temperature	190 ± 2 K
Ambient diffraction temperature	190 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0983
Residual factor for significantly intense reflections	0.0531
Weighted residual factors for significantly intense reflections	0.1152
Weighted residual factors for all reflections included in the refinement	0.1402
Goodness-of-fit parameter for all reflections included in the refinement	1.027
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
285535 (current)	2023-08-05	cif/ Updating files of 1569359 Original log message: Adding full bibliography for 1569359.cif.	1569359.cif
284671	2023-06-29	cif/ Adding structures of 1569359 via cif-deposit CGI script.	1569359.cif