Crystallography Open Database

Information card for entry 4511273

Preview

Coordinates	4511273.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H58 Ag2 F12 N10 O2 P2
Calculated formula	C40 H58 Ag2 F12 N10 O2 P2
Title of publication	Metal Supramolecular Frameworks with Silver and Ditopic Bis(pyrazolyl)methane Ligands: Effect of the Anions and Ligand Substitution
Authors of publication	Durá, Gema; Carrión, M. Carmen; Jalón, Félix A.; Rodríguez, Ana M.; Manzano, Blanca R.
Journal of publication	Crystal Growth & Design
Year of publication	2014
Journal volume	14
Journal issue	7
Pages of publication	3510
a	13.631 ± 0.005 Å
b	14.877 ± 0.005 Å
c	14.093 ± 0.005 Å
α	90°
β	118.414 ± 0.004°
γ	90°
Cell volume	2513.6 ± 1.5 Å³
Cell temperature	230 ± 2 K
Ambient diffraction temperature	230 ± 2 K
Number of distinct elements	7
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	0.1897
Residual factor for significantly intense reflections	0.0761
Weighted residual factors for significantly intense reflections	0.1968
Weighted residual factors for all reflections included in the refinement	0.2794
Goodness-of-fit parameter for all reflections included in the refinement	0.902
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
179659 (current)	2016-03-24	cif/4/51/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/51/12.	4511273.cif
119049	2014-07-05	cif/ Updating files of 4511266, 4511267, 4511268, 4511269, 4511270, 4511271, 4511272, 4511273, 4511274 Original log message: Adding full bibliography for 4511266--4511274.cif.	4511273.cif
115953	2014-06-06	cif/ Adding structures of 4511266, 4511267, 4511268, 4511269, 4511270, 4511271, 4511272, 4511273, 4511274 via cif-deposit CGI script.	4511273.cif