Crystallography Open Database

Information card for entry 7210346

Preview

Coordinates	7210346.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C21 H16 N2 O7 Zn
Calculated formula	C21 H16 N2 O7 Zn
Title of publication	A series of coordination complexes based on unsymmetrical multicarboxylate ligands: syntheses, structures and properties
Authors of publication	Hu, Dong-Hua; Sun, Chun-Yi; Liu, Fu-Hong; Qin, Chao; Wang, Xin-Long; Su, Zhong-Min
Journal of publication	CrystEngComm
Year of publication	2013
Journal volume	15
Journal issue	34
Pages of publication	6769
a	10.7045 ± 0.0017 Å
b	13.064 ± 0.002 Å
c	16.586 ± 0.003 Å
α	90°
β	108.546 ± 0.002°
γ	90°
Cell volume	2199 ± 0.6 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.084
Residual factor for significantly intense reflections	0.0653
Weighted residual factors for significantly intense reflections	0.1853
Weighted residual factors for all reflections included in the refinement	0.2052
Goodness-of-fit parameter for all reflections included in the refinement	1.055
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
180434 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/03.	7210346.cif
87603	2013-08-27	cif/ Adding structures of 7210342, 7210343, 7210344, 7210345, 7210346, 7210347 via cif-deposit CGI script.	7210346.cif