Crystallography Open Database

Information card for entry 4511555

Preview

Coordinates	4511555.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	CBC
Formula	C10 H10 Ag F6 N4 P S
Calculated formula	C10 H10 Ag F6 N4 P S
Title of publication	Increasing Structural Dimensionality in Ag(I) Coordination Polymers Formed from the Same Flexible Multimodal Thioether Pyrazine Ligand
Authors of publication	Amoore, Jarrod J. M.; Black, Cory A.; Hanton, Lyall R.; Spicer, Mark D.
Journal of publication	Crystal Growth & Design
Year of publication	2005
Journal volume	5
Journal issue	3
Pages of publication	1255
a	9.9188 ± 0.0002 Å
b	12.8858 ± 0.0005 Å
c	11.7449 ± 0.0004 Å
α	90°
β	100.646 ± 0.002°
γ	90°
Cell volume	1475.3 ± 0.08 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	7
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	0.0404
Residual factor for significantly intense reflections	0.0276
Weighted residual factors for significantly intense reflections	0.0575
Weighted residual factors for all reflections included in the refinement	0.062
Goodness-of-fit parameter for all reflections included in the refinement	1.053
Diffraction radiation probe	x-ray
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.	4511555.cif
119737	2014-07-08	cif/ Adding structures of 4511554, 4511555, 4511556 via cif-deposit CGI script.	4511555.cif