Crystallography Open Database

Information card for entry 4502658

Preview

Coordinates	4502658.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C23 H21 N4 O8 Zn2
Calculated formula	C23 H21 N4 O8 Zn2
Title of publication	Synthesis, Structures, and Properties of Zinc(II) and Cadmium(II) Complexes with 1,2,4,5-Tetrakis(imidazol-1-ylmethyl)benzene and Multicarboxylate Ligands
Authors of publication	Hua, Qin; Zhao, Yue; Xu, Guan-Cheng; Chen, Man-Sheng; Su, Zhi; Cai, Kai; Sun, Wei-Yin
Journal of publication	Crystal Growth & Design
Year of publication	2010
Journal volume	10
Journal issue	6
Pages of publication	2553
a	9.9236 ± 0.0013 Å
b	11.6713 ± 0.0015 Å
c	11.9072 ± 0.0016 Å
α	98.271 ± 0.002°
β	109.803 ± 0.001°
γ	99.816 ± 0.002°
Cell volume	1248 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 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	0.0565
Residual factor for significantly intense reflections	0.0399
Weighted residual factors for significantly intense reflections	0.0934
Weighted residual factors for all reflections included in the refinement	0.0971
Goodness-of-fit parameter for all reflections included in the refinement	0.909
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
179557 (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 4/50/26.	4502658.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4502658.cif
36503	2012-03-01	../uploads/cif-deposit/cod/cif Adding structures of 4502654, 4502655, 4502656, 4502657, 4502658 via cif-deposit CGI script.	4502658.cif