Crystallography Open Database

Information card for entry 4512168

Preview

Coordinates	4512168.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	(acetonitrile)bis(diazabicyclo[2.2.2]octane)silver(I) cobalticarborane
Formula	C30 H86 Ag2 B36 Co2 N8
Calculated formula	C30 H86 Ag2 B36 Co2 N8
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	21.585 ± 0.002 Å
b	13.4043 ± 0.0014 Å
c	22.089 ± 0.002 Å
α	90°
β	110.814 ± 0.003°
γ	90°
Cell volume	5974 ± 1 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 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	0.1724
Residual factor for significantly intense reflections	0.158
Weighted residual factors for significantly intense reflections	0.4439
Weighted residual factors for all reflections included in the refinement	0.4523
Goodness-of-fit parameter for all reflections included in the refinement	1.094
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.	4512168.cif
126840	2014-11-11	cif/ Updating files of 4512167, 4512168, 4512169 Original log message: Adding full bibliography for 4512167--4512169.cif.	4512168.cif
125670	2014-10-22	cif/ Adding structures of 4512168 via cif-deposit CGI script.	4512168.cif