Crystallography Open Database

Information card for entry 7214403

Preview

Coordinates	7214403.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C41 H60 Cd2 N4 O20
Calculated formula	C41 H60 Cd2 N4 O20
Title of publication	Syntheses, characterization, and properties of five coordination compounds based on the ligand tetrakis(4-pyridyloxymethylene)methane
Authors of publication	Ju, Zemin; Cao, Dapeng; Qin, Ling; Zhang, Chuanlei; Zhang, Mingdao; Shi, Zhiqiang; Zheng, Hegen
Journal of publication	CrystEngComm
Year of publication	2014
Journal volume	16
Journal issue	19
Pages of publication	3917
a	11.4622 ± 0.0015 Å
b	9.4091 ± 0.0012 Å
c	22.611 ± 0.003 Å
α	90°
β	91.698 ± 0.002°
γ	90°
Cell volume	2437.5 ± 0.6 Å³
Cell temperature	291 ± 2 K
Ambient diffraction temperature	291 ± 2 K
Number of distinct elements	5
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/c 1
Hall space group symbol	-P 2yc
Residual factor for all reflections	0.0554
Residual factor for significantly intense reflections	0.0459
Weighted residual factors for significantly intense reflections	0.1212
Weighted residual factors for all reflections included in the refinement	0.1302
Goodness-of-fit parameter for all reflections included in the refinement	1.051
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
176432 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	7214403.cif
109530	2014-04-16	cif/ Adding structures of 7214399, 7214400, 7214401, 7214402, 7214403 via cif-deposit CGI script.	7214403.cif