Crystallography Open Database

Information card for entry 7205964

7205963 << 7205964 >> 7205965

Preview

Coordinates	7205964.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C13 H10 Ag2 Br N5 O9
Calculated formula	C13 H10 Ag2 Br N5 O9
Title of publication	Diverse Ag(i) complexes constructed from methyl-4-(5-halopyrimidin-2-ylcarbamoyl)benzoate ligands: roles of the halogen atom and anion
Authors of publication	Wu, Chia-Jun; Sie, Ming-Jhe; Hsiao, Hui-Lin; Chen, Jhy-Der
Journal of publication	CrystEngComm
Year of publication	2011
Journal volume	13
Journal issue	12
Pages of publication	4121
a	7.5949 ± 0.0009 Å
b	10.1026 ± 0.0014 Å
c	12.8377 ± 0.0016 Å
α	89.295 ± 0.01°
β	79.941 ± 0.011°
γ	70.855 ± 0.01°
Cell volume	915.2 ± 0.2 Å³
Cell temperature	295 ± 2 K
Ambient diffraction temperature	295 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0802
Residual factor for significantly intense reflections	0.0407
Weighted residual factors for significantly intense reflections	0.0692
Weighted residual factors for all reflections included in the refinement	0.0806
Goodness-of-fit parameter for all reflections included in the refinement	1.006
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
180390 (current)	2016-03-26	cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/59.	7205964.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7205964.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7205964.cif
21299	2011-06-22	../uploads/cif-deposit/cod/cif Adding structures of 7205962, 7205963, 7205964, 7205965, 7205966, 7205967, 7205968, 7205969 via cif-deposit CGI script.	7205964.cif