Crystallography Open Database

Information card for entry 1556442

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Coordinates	1556442.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H78 K N4 O7 Si4 Zn
Calculated formula	C38 H78 K N4 O7 Si4 Zn
SMILES	c1cccc2c3cccc[n]3[Zn]([n]12)(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C.[O]12CC[O]3CC[O]4[K]5623([O](CC)CC)[O](CC[O]6CC[O]5CC1)CC4
Title of publication	Reduction of 2,2'-Bipyridine by Quasi-Linear 3d-Metal(I) Silylamides-A Structural and Spectroscopic Study
Authors of publication	Muller, I.; Schneider, C.; Pietzonka, C.; Kraus, F.; Werncke, C.G.
Journal of publication	Inorganics
Year of publication	2019
Journal volume	7
Pages of publication	117
a	12.1899 ± 0.0007 Å
b	18.4365 ± 0.001 Å
c	22.8273 ± 0.0013 Å
α	90°
β	95.423 ± 0.002°
γ	90°
Cell volume	5107.2 ± 0.5 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.1506
Residual factor for significantly intense reflections	0.1281
Weighted residual factors for significantly intense reflections	0.2499
Weighted residual factors for all reflections included in the refinement	0.2596
Goodness-of-fit parameter for all reflections included in the refinement	1.086
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
244939 (current)	2019-12-06	cif/ Adding structures of 1556442 via cif-deposit CGI script.	1556442.cif