Crystallography Open Database

Information card for entry 4115643

Preview

Coordinates	4115643.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C35 H11 Ag11 F45 N3 O19
Calculated formula	C35 Ag11 F45 N3 O19
Title of publication	Argentophilicity and Solvent-Induced Structural Diversity in Double Salts of Silver Acetylide with Silver Perfluoroalkyl Carboxylates
Authors of publication	Quan-Ming Wang; Thomas C. W. Mak
Journal of publication	Journal of the American Chemical Society
Year of publication	2001
Journal volume	123
Pages of publication	7594 - 7600
a	16.083 ± 0.0012 Å
b	19.9707 ± 0.0015 Å
c	21.994 ± 0.0016 Å
α	90°
β	94.935 ± 0.002°
γ	90°
Cell volume	7038 ± 0.9 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0939
Residual factor for significantly intense reflections	0.0478
Weighted residual factors for significantly intense reflections	0.1241
Weighted residual factors for all reflections included in the refinement	0.1338
Goodness-of-fit parameter for all reflections included in the refinement	0.816
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
178927 (current)	2016-03-22	cif/4/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/11/56.	4115643.cif
120077	2014-07-12	Adding DOIs to range 4/11 structures.	4115643.cif
69245	2012-12-04	cif/ Adding structures of 4115643 via cif-deposit CGI script.	4115643.cif