Crystallography Open Database

Information card for entry 4505549

Preview

Coordinates	4505549.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C56 H64 Ag4 N8 O21
Calculated formula	C56 H64 Ag4 N8 O21
Title of publication	Syntheses, Structures, and Properties of Silver‒Organic Frameworks Constructed with 1,1′-Biphenyl-2,2′,6,6′-tetracarboxylic Acid
Authors of publication	Li, Bo; Zang, Shuang-Quan; Ji, Can; Hou, Hong-Wei; Mak, Thomas C. W.
Journal of publication	Crystal Growth & Design
Year of publication	2012
Journal volume	12
Journal issue	3
Pages of publication	1443
a	14.4608 ± 0.0005 Å
b	15.5768 ± 0.0006 Å
c	16.2543 ± 0.0007 Å
α	77.43 ± 0.003°
β	87.842 ± 0.003°
γ	66.798 ± 0.004°
Cell volume	3279.8 ± 0.2 Å³
Cell temperature	296 K
Ambient diffraction temperature	296 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0752
Residual factor for significantly intense reflections	0.0499
Weighted residual factors for significantly intense reflections	0.1348
Weighted residual factors for all reflections included in the refinement	0.1472
Goodness-of-fit parameter for all reflections included in the refinement	1.062
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
179590 (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 4/50/55.	4505549.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4505549.cif
51807	2012-04-07	../uploads/cif-deposit/cod/cif Adding structures of 4505549, 4505550, 4505551, 4505552, 4505553 via cif-deposit CGI script.	4505549.cif