Crystallography Open Database

Information card for entry 7113217

Preview

Coordinates	7113217.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C204 H171 Ag5 F30 N24 O1.5 Sb5
Calculated formula	C204 H168 Ag5 F29.96 N24 O1.5 Sb4.99
Title of publication	Formation of two (6,3) networks showing structural diversity, Borromean topology and conformational chirality in the same crystal
Authors of publication	Zhang, Xue-Li; Guo, Cui-Ping; Yang, Qing-Yuan; Wang, Wei; Liu, Wei-Sheng; Kang, Bei-Sheng; Su, Cheng-Yong
Journal of publication	Chemical Communications (Cambridge, United Kingdom)
Year of publication	2007
Journal issue	41
Pages of publication	4242 - 4244
a	17.9271 ± 0.0006 Å
b	17.9271 ± 0.0006 Å
c	37.53 ± 0.003 Å
α	90°
β	90°
γ	120°
Cell volume	10445.5 ± 1 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	7
Space group number	182
Hermann-Mauguin space group symbol	P 63 2 2
Hall space group symbol	P 6c 2c
Residual factor for all reflections	0.0984
Residual factor for significantly intense reflections	0.0811
Weighted residual factors for significantly intense reflections	0.1836
Weighted residual factors for all reflections included in the refinement	0.1924
Goodness-of-fit parameter for all reflections included in the refinement	1.011
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Duplicate of	7102227
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
210751 (current)	2018-09-10	cif/7/ Updating bibliography in entries 7102226-7102227, 7113216-7113217. Marking entries 7113216-7113217 as duplicates of entries 7102226-7102227.	7113217.cif
176453	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7113217.cif
113388	2014-05-12	cif/ Adding structures of 7113216, 7113217 via cif-deposit CGI script.	7113217.cif