Crystallography Open Database

Information card for entry 4088276

Preview

Coordinates	4088276.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C31 H40 F6 N2 Zn
Calculated formula	C31 H40 F6 N2 Zn
Title of publication	Electron-Deficient β-Diiminato-Zinc-Ethyl Complexes: Synthesis, Structure, and Reactivity in Ring-Opening Polymerization of Lactones
Authors of publication	Kronast, Alexander; Reiter, Marina; Altenbuchner, Peter T.; Jandl, Christian; Pöthig, Alexander; Rieger, Bernhard
Journal of publication	Organometallics
Year of publication	2016
Journal volume	35
Journal issue	5
Pages of publication	681
a	35.229 ± 0.0011 Å
b	11.4852 ± 0.0003 Å
c	16.5381 ± 0.0005 Å
α	90°
β	111.691 ± 0.001°
γ	90°
Cell volume	6217.7 ± 0.3 Å³
Cell temperature	123 K
Ambient diffraction temperature	123 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0429
Residual factor for significantly intense reflections	0.0387
Weighted residual factors for significantly intense reflections	0.0937
Weighted residual factors for all reflections included in the refinement	0.0969
Goodness-of-fit parameter for all reflections included in the refinement	1.035
Diffraction radiation probe	x-ray
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
237433 (current)	2019-11-24	cif/ Adding structures of 4088276, 4088277, 4088278 via cif-deposit CGI script.	4088276.cif