Crystallography Open Database

Information card for entry 4512167

Preview

Coordinates	4512167.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	bis(diazabicyclo[2.2.2]octane)silver(I)perrhenate acetonitrile solvate
Formula	C20 H36 Ag N8 O4 Re
Calculated formula	C12 H24 Ag N4 Re1.00235
Title of publication	Three-Dimensional Silver-dabco Coordination Polymers with Zeolitic or Three-Connected Topology
Authors of publication	Thorp-Greenwood, Flora L.; Kulak, Alexander N.; Hardie, Michaele J.
Journal of publication	Crystal Growth & Design
Year of publication	2014
Journal volume	14
Journal issue	11
Pages of publication	5361
a	45.611 ± 0.001 Å
b	45.611 ± 0.001 Å
c	45.611 ± 0.001 Å
α	90°
β	90°
γ	90°
Cell volume	94887 ± 4 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	227
Hermann-Mauguin space group symbol	F d -3 m :2
Hall space group symbol	-F 4vw 2vw 3
Residual factor for all reflections	0.0996
Residual factor for significantly intense reflections	0.0782
Weighted residual factors for significantly intense reflections	0.2352
Weighted residual factors for all reflections included in the refinement	0.2615
Goodness-of-fit parameter for all reflections included in the refinement	1.103
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
179668 (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 4/51/21.	4512167.cif
126840	2014-11-11	cif/ Updating files of 4512167, 4512168, 4512169 Original log message: Adding full bibliography for 4512167--4512169.cif.	4512167.cif
125669	2014-10-22	cif/ Adding structures of 4512167 via cif-deposit CGI script.	4512167.cif