Crystallography Open Database

Information card for entry 4504380

Preview

Coordinates	4504380.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	compound 1 cbao
Formula	C11 H11 Ag B F4 N3 S
Calculated formula	C11 H11 Ag B F4 N3 S
Title of publication	An Atypical Network: Noninterpenetrating (10,3)-d Nets Using an Unsymmetrical Flexible Ligand and Ag(I) as Three-Connected Nodes
Authors of publication	Black, Cory A.; Hanton, Lyall R.
Journal of publication	Crystal Growth & Design
Year of publication	2007
Journal volume	7
Journal issue	9
Pages of publication	1868
a	13.173 ± 0.005 Å
b	8.493 ± 0.005 Å
c	12.555 ± 0.005 Å
α	90°
β	90°
γ	90°
Cell volume	1404.6 ± 1.1 Å³
Cell temperature	89 ± 2 K
Ambient diffraction temperature	89 ± 2 K
Number of distinct elements	7
Space group number	33
Hermann-Mauguin space group symbol	P n a 21
Hall space group symbol	P 2c -2n
Residual factor for all reflections	0.0542
Residual factor for significantly intense reflections	0.0439
Weighted residual factors for significantly intense reflections	0.1202
Weighted residual factors for all reflections included in the refinement	0.1278
Goodness-of-fit parameter for all reflections included in the refinement	1.109
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179578 (current)	2016-03-24	cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/43.	4504380.cif
120110	2014-07-12	Adding DOIs to range 4/50 structures.	4504380.cif
45095	2012-03-20	../uploads/cif-deposit/cod/cif Adding structures of 4504380, 4504381, 4504382 via cif-deposit CGI script.	4504380.cif