Crystallography Open Database

Information card for entry 7111372

Preview

Coordinates	7111372.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C33 H24 F9 N6 O17 S3 Yb
Calculated formula	C33 H24 F9 N6 O17 S3 Yb
Title of publication	Unprecedented bilayer topologies in 5- and 6-connected framework polymersElectronic supplementary information (ESI) available: synthesis, characterisation, additional views and crystallographic details. See http://www.rsc.org/suppdata/cc/b4/b407554d/
Authors of publication	Hill, Robert J.; Long, De-Liang; Turvey, Mark S.; Blake, Alexander J.; Champness, Neil R.; Hubberstey, Peter; Wilson, Claire; Schr�der, Martin
Journal of publication	Chemical Communications
Year of publication	2004
Journal issue	16
Pages of publication	1792 - 1793
a	16.794 ± 0.003 Å
b	13.764 ± 0.003 Å
c	20.044 ± 0.004 Å
α	90°
β	90°
γ	90°
Cell volume	4633.2 ± 1.6 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	7
Space group number	54
Hermann-Mauguin space group symbol	P c c a
Hall space group symbol	-P 2a 2ac
Residual factor for all reflections	0.14
Residual factor for significantly intense reflections	0.0965
Weighted residual factors for significantly intense reflections	0.2217
Weighted residual factors for all reflections included in the refinement	0.2489
Goodness-of-fit parameter for all reflections included in the refinement	1.223
Diffraction radiation probe	x-ray
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
180227 (current)	2016-03-26	cif/7/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/11/13.	7111372.cif
96462	2014-01-29	cif/ Adding structures of 7111372, 7111373, 7111374, 7111375, 7111376 via cif-deposit CGI script.	7111372.cif