Crystallography Open Database

Information card for entry 7216555

Preview

Coordinates	7216555.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C63 H132 Ag20 N2 O23 S10
Calculated formula	C63 H132 Ag20 N2 O23 S10
Title of publication	Unexpected 1D self-assembly of carbonate-templated sandwich-like macrocycle-based Ag20S10luminescent nanoclusters
Authors of publication	Zhou, Kun; Qin, Chao; Wang, Xin-Long; Shao, Kui-Zhan; Yan, Li-Kai; Su, Zhong-Min
Journal of publication	CrystEngComm
Year of publication	2014
Journal volume	16
Journal issue	34
Pages of publication	7860
a	12.947 ± 0.005 Å
b	15.169 ± 0.005 Å
c	15.922 ± 0.005 Å
α	67.605 ± 0.005°
β	82.355 ± 0.005°
γ	65.089 ± 0.005°
Cell volume	2620.7 ± 1.6 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1109
Residual factor for significantly intense reflections	0.0614
Weighted residual factors for significantly intense reflections	0.1519
Weighted residual factors for all reflections included in the refinement	0.1765
Goodness-of-fit parameter for all reflections included in the refinement	0.988
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
180496 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/65.	7216555.cif
121608	2014-08-08	cif/ Updating files of 7216555 Original log message: Adding full bibliography for 7216555.cif.	7216555.cif
116488	2014-06-13	cif/ Adding structures of 7216555 via cif-deposit CGI script.	7216555.cif