Crystallography Open Database

Information card for entry 7206973

7206972 << 7206973 >> 7206974

Preview

Coordinates	7206973.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C44 H46 Cu2 N4 O13
Calculated formula	C44 H46 Cu2 N4 O13
Title of publication	Divalent metal coordination polymers assembled from dual linkers ‒ semirigid carboxyphenylpropionate and dipyridyl type molecule
Authors of publication	Liu, Guang-Zhen; Wang, Jian-Ge; Wang, Li-Ya
Journal of publication	CrystEngComm
Year of publication	2012
Journal volume	14
Journal issue	3
Pages of publication	951
a	16.475 ± 0.003 Å
b	20.866 ± 0.004 Å
c	12.955 ± 0.002 Å
α	90°
β	92.389 ± 0.002°
γ	90°
Cell volume	4449.6 ± 1.4 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	9
Hermann-Mauguin space group symbol	C 1 c 1
Hall space group symbol	C -2yc
Residual factor for all reflections	0.0562
Residual factor for significantly intense reflections	0.0407
Weighted residual factors for significantly intense reflections	0.088
Weighted residual factors for all reflections included in the refinement	0.0951
Goodness-of-fit parameter for all reflections included in the refinement	1.029
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
180400 (current)	2016-03-26	cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/69.	7206973.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7206973.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7206973.cif
32452	2012-02-09	../uploads/cif-deposit/cod/cif Adding structures of 7206972, 7206973, 7206974, 7206975, 7206976, 7206977 via cif-deposit CGI script.	7206973.cif