Crystallography Open Database

Information card for entry 4332235

Preview

Coordinates	4332235.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H32.5 Ag F3 N1.5 O3 P2 S
Calculated formula	C42 H32.5 Ag F3 N1.5 O3 P2 S
Title of publication	Self-Assembly, Structures, and Solution Dynamics of Emissive Silver Metallacycles and Helices
Authors of publication	Lin, Ronger; Yip, John H. K.
Journal of publication	Inorganic Chemistry
Year of publication	2006
Journal volume	45
Journal issue	11
Pages of publication	4423 - 4430
a	14.092 ± 0.002 Å
b	9.7574 ± 0.0015 Å
c	29.812 ± 0.005 Å
α	90°
β	101.907 ± 0.004°
γ	90°
Cell volume	4011 ± 1.1 Å³
Cell temperature	223 ± 2 K
Ambient diffraction temperature	223 ± 2 K
Number of distinct elements	8
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.1091
Residual factor for significantly intense reflections	0.0664
Weighted residual factors for significantly intense reflections	0.1698
Weighted residual factors for all reflections included in the refinement	0.1868
Goodness-of-fit parameter for all reflections included in the refinement	0.954
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
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4332235.cif
98176	2014-01-29	cif/ Adding structures of 4332235 via cif-deposit CGI script.	4332235.cif