Crystallography Open Database

Information card for entry 4509487

Preview

Coordinates	4509487.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C321 H228 Ag8 F48 N12 O6 S18 Sb8
Calculated formula	C321 H228 Ag8 F48 N12 O6 S18 Sb8
Title of publication	Networks of Hexagonal Hierarchy from a Self-Similar Tritopic Molecule
Authors of publication	Sun, Yan-Qiong; Yang, Chen; Xu, Zhengtao; Zeller, Matthias; Hunter, Allen D.
Journal of publication	Crystal Growth & Design
Year of publication	2009
Journal volume	9
Journal issue	4
Pages of publication	1663
a	27.305 ± 0.0014 Å
b	27.305 ± 0.0014 Å
c	77.304 ± 0.008 Å
α	90°
β	90°
γ	120°
Cell volume	49913 ± 6 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	8
Space group number	167
Hermann-Mauguin space group symbol	R -3 c :H
Hall space group symbol	-R 3 2"c
Residual factor for all reflections	0.1657
Residual factor for significantly intense reflections	0.1048
Weighted residual factors for significantly intense reflections	0.3027
Weighted residual factors for all reflections included in the refinement	0.3445
Goodness-of-fit parameter for all reflections included in the refinement	1.05
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
179630 (current)	2016-03-24	cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/94.	4509487.cif
97317	2014-01-29	cif/ Adding structures of 4509487 via cif-deposit CGI script.	4509487.cif