Crystallography Open Database

Information card for entry 1549244

Preview

Coordinates	1549244.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H56 Cu F6 N3 Sb Si3
Calculated formula	C36 H56 Cu F6 N3 Sb Si3
Title of publication	Taming a monomeric [Cu(η<sup>6</sup>-C<sub>6</sub>H<sub>6</sub>)]<sup>+</sup> complex with silylene.
Authors of publication	Parvin, Nasrina; Pal, Shiv; Echeverría, Jorge; Alvarez, Santiago; Khan, Shabana
Journal of publication	Chemical science
Year of publication	2018
Journal volume	9
Journal issue	18
Pages of publication	4333 - 4337
a	14.617 ± 0.007 Å
b	14.759 ± 0.007 Å
c	21.243 ± 0.01 Å
α	90°
β	107.874 ± 0.01°
γ	90°
Cell volume	4362 ± 4 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.1162
Residual factor for significantly intense reflections	0.0586
Weighted residual factors for significantly intense reflections	0.1179
Weighted residual factors for all reflections included in the refinement	0.1441
Goodness-of-fit parameter for all reflections included in the refinement	1.01
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
228823 (current)	2019-11-17	cif/ Updating files of 1549244, 1549245, 1549246, 1549247 Original log message: Adding full bibliography for 1549244--1549247.cif.	1549244.cif
207340	2018-04-15	cif/ Adding structures of 1549244, 1549245, 1549246, 1549247 via cif-deposit CGI script.	1549244.cif