Crystallography Open Database

Information card for entry 4501610

Preview

Coordinates	4501610.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C41 H40 N4 O16 Zn2
Calculated formula	C41 H40 N4 O16 Zn2
Title of publication	Syntheses, Structures, and Photoluminescence of Five New Metal−Organic Frameworks Based on Flexible Tetrapyridines and Aromatic Polycarboxylate Acids
Authors of publication	Hu, Jin-Song; Shang, Yong-Jia; Yao, Xiao-qiang; Qin, Ling; Li, Yi-Zhi; Guo, Zi-Jian; Zheng, He-Gen; Xue, Zi-Ling
Journal of publication	Crystal Growth & Design
Year of publication	2010
Journal volume	10
Journal issue	6
Pages of publication	2676
a	9.3046 ± 0.0011 Å
b	25.778 ± 0.003 Å
c	20.4387 ± 0.0018 Å
α	90°
β	106.475 ± 0.004°
γ	90°
Cell volume	4701 ± 0.9 Å³
Cell temperature	291 ± 2 K
Ambient diffraction temperature	291 ± 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	0.1009
Residual factor for significantly intense reflections	0.0726
Weighted residual factors for significantly intense reflections	0.1924
Weighted residual factors for all reflections included in the refinement	0.2091
Goodness-of-fit parameter for all reflections included in the refinement	1.048
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
179547 (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 4/50/16.	4501610.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4501610.cif
35988	2012-03-01	../uploads/cif-deposit/cod/cif Adding structures of 4501606, 4501607, 4501608, 4501609, 4501610, 4501611 via cif-deposit CGI script.	4501610.cif