Crystallography Open Database

Information card for entry 7210405

Preview

Coordinates	7210405.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C80 H74 Ag2 F12 N10 O2 P2
Calculated formula	C80 H74 Ag2 F12 N10 O2 P2
Title of publication	Dinuclear Ag(i) metallamacrocycles of bis-N-heterocyclic carbenes bridged by calixarene fragments: synthesis, structure and chemosensing behavior
Authors of publication	Lin, Cai-Xia; Kong, Xiao-Fei; Li, Qing-Shan; Zhang, Zheng-Zhi; Yuan, Yao-Feng; Xu, Feng-Bo
Journal of publication	CrystEngComm
Year of publication	2013
Journal volume	15
Journal issue	35
Pages of publication	6948
a	11.967 ± 0.003 Å
b	13.539 ± 0.003 Å
c	13.776 ± 0.004 Å
α	116.722 ± 0.012°
β	96.41 ± 0.02°
γ	103.815 ± 0.017°
Cell volume	1873.2 ± 0.9 Å³
Cell temperature	113 ± 2 K
Ambient diffraction temperature	113 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0415
Residual factor for significantly intense reflections	0.0345
Weighted residual factors for significantly intense reflections	0.0688
Weighted residual factors for all reflections included in the refinement	0.0713
Goodness-of-fit parameter for all reflections included in the refinement	0.985
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
180435 (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 7/21/04.	7210405.cif
87617	2013-08-27	cif/ Adding structures of 7210403, 7210404, 7210405, 7210406, 7210407, 7210408 via cif-deposit CGI script.	7210405.cif