Crystallography Open Database

Information card for entry 4502833

Preview

Coordinates	4502833.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H24 N8 O14 Zn3
Calculated formula	C30 H24 N8 O14 Zn3
Title of publication	Structure Modulation in Zn(II)‒1,4-Bis(imidazol-1-yl)benzene Frameworks by Varying Dicarboxylate Anions
Authors of publication	Li, Yun-Wu; Ma, Hong; Chen, Yong-Qiang; He, Kun-Huan; Li, Zuo-Xi; Bu, Xian-He
Journal of publication	Crystal Growth & Design
Year of publication	2012
Journal volume	12
Journal issue	1
Pages of publication	189
a	15.109 ± 0.003 Å
b	20.8 ± 0.004 Å
c	12.03 ± 0.002 Å
α	90°
β	118.22 ± 0.03°
γ	90°
Cell volume	3331.3 ± 1.4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0713
Residual factor for significantly intense reflections	0.0487
Weighted residual factors for significantly intense reflections	0.0878
Weighted residual factors for all reflections included in the refinement	0.0944
Goodness-of-fit parameter for all reflections included in the refinement	1.104
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
179559 (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 4/50/28.	4502833.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4502833.cif
37763	2012-03-04	../uploads/cif-deposit/cod/cif Adding structures of 4502828, 4502829, 4502830, 4502831, 4502832, 4502833 via cif-deposit CGI script.	4502833.cif