Crystallography Open Database

Information card for entry 4504765

Preview

Coordinates	4504765.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H14 Ag F6 N4 O2 P
Calculated formula	C18 H14 Ag F6 N4 O2 P
Title of publication	Hierarchy of Hydrogen Bonding versus Anion Binding in Self-Assembled Network Structures of Silver(I)
Authors of publication	Burchell, Tara J.; Eisler, Dana J.; Puddephatt, Richard J.
Journal of publication	Crystal Growth & Design
Year of publication	2006
Journal volume	6
Journal issue	4
Pages of publication	974
a	8.7166 ± 0.0017 Å
b	13.711 ± 0.003 Å
c	9.2663 ± 0.0019 Å
α	90°
β	112.1 ± 0.03°
γ	90°
Cell volume	1026.1 ± 0.4 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	7
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0552
Residual factor for significantly intense reflections	0.0466
Weighted residual factors for significantly intense reflections	0.1168
Weighted residual factors for all reflections included in the refinement	0.1237
Goodness-of-fit parameter for all reflections included in the refinement	1.038
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
179582 (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 4/50/47.	4504765.cif
120110	2014-07-12	Adding DOIs to range 4/50 structures.	4504765.cif
47513	2012-03-26	../uploads/cif-deposit/cod/cif Adding structures of 4504760, 4504761, 4504762, 4504763, 4504764, 4504765 via cif-deposit CGI script.	4504765.cif