Crystallography Open Database

Information card for entry 4509109

Preview

Coordinates	4509109.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C104 H72 N20 O18 Zn4
Calculated formula	C104 H72 N20 O18 Zn4
Title of publication	Self-Assembly of Metal−Organic Coordination Polymers Constructed from a Versatile Multipyridyl Ligand: Diversity of Coordination Modes and Structures
Authors of publication	Liang, Xiao-Qiang; Zhou, Xin-Hui; Chen, Chao; Xiao, Hong-Ping; Li, Yi-Zhi; Zuo, Jing-Lin; You, Xiao-Zeng
Journal of publication	Crystal Growth & Design
Year of publication	2009
Journal volume	9
Journal issue	2
Pages of publication	1041
a	10.706 ± 0.002 Å
b	12.227 ± 0.003 Å
c	19.154 ± 0.004 Å
α	90°
β	96.946 ± 0.004°
γ	90°
Cell volume	2488.9 ± 0.9 Å³
Cell temperature	291 ± 2 K
Ambient diffraction temperature	291 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.097
Residual factor for significantly intense reflections	0.0679
Weighted residual factors for significantly intense reflections	0.1468
Weighted residual factors for all reflections included in the refinement	0.1543
Goodness-of-fit parameter for all reflections included in the refinement	1.049
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
179627 (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 4/50/91.	4509109.cif
97111	2014-01-29	cif/ Adding structures of 4509106, 4509107, 4509108, 4509109, 4509110, 4509111 via cif-deposit CGI script.	4509109.cif