Crystallography Open Database

Information card for entry 4131595

Preview

Coordinates	4131595.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C82.18 H149.09 Co12 Mo6 N6.55 O21 P8 Se16
Calculated formula	C82.176 H149.088 Co12 Mo6 N6.544 O21 P8 Se16
Title of publication	Weaving Nanoscale Cloth through Electrostatic Templating.
Authors of publication	Champsaur, Anouck M.; Mézière, Cécile; Allain, Magali; Paley, Daniel W.; Steigerwald, Michael L.; Nuckolls, Colin; Batail, Patrick
Journal of publication	Journal of the American Chemical Society
Year of publication	2017
Journal volume	139
Journal issue	34
Pages of publication	11718 - 11721
a	21.65893 ± 0.00019 Å
b	21.65893 ± 0.00019 Å
c	28.918 ± 0.0004 Å
α	90°
β	90°
γ	90°
Cell volume	13565.7 ± 0.3 Å³
Cell temperature	100.01 ± 0.1 K
Ambient diffraction temperature	100.01 ± 0.1 K
Number of distinct elements	8
Space group number	130
Hermann-Mauguin space group symbol	P 4/n c c :2
Hall space group symbol	-P 4a 2ac
Residual factor for all reflections	0.0526
Residual factor for significantly intense reflections	0.0422
Weighted residual factors for significantly intense reflections	0.1061
Weighted residual factors for all reflections included in the refinement	0.115
Goodness-of-fit parameter for all reflections included in the refinement	1.05
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
241772 (current)	2019-11-25	cif/ Adding structures of 4131595 via cif-deposit CGI script.	4131595.cif