Crystallography Open Database

Information card for entry 7215014

Preview

Coordinates	7215014.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H28 Cd N4 O5
Calculated formula	C22 H26 Cd N4 O5.5
Title of publication	Isomeric phenylenediacetates as modular tectons for a series of ZnII/CdII coordination polymers incorporating flexible bis(imidazole) co-ligands
Authors of publication	Wu, Ya-Pan; Li, Dong-Sheng; Zhao, Jun; Fang, Zi-Fan; Dong, Wen-Wen; Yang, Guo-Ping; Wang, Yao-Yu
Journal of publication	CrystEngComm
Year of publication	2012
Journal volume	14
Journal issue	14
Pages of publication	4745
a	20.517 ± 0.0017 Å
b	10.5876 ± 0.0009 Å
c	21.9335 ± 0.0018 Å
α	90°
β	105.419 ± 0.001°
γ	90°
Cell volume	4593 ± 0.7 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 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	0.0511
Residual factor for significantly intense reflections	0.0399
Weighted residual factors for significantly intense reflections	0.1075
Weighted residual factors for all reflections included in the refinement	0.1179
Goodness-of-fit parameter for all reflections included in the refinement	1.021
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
180481 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/50.	7215014.cif
111013	2014-04-20	cif/ Adding structures of 7215008, 7215009, 7215010, 7215011, 7215012, 7215013, 7215014 via cif-deposit CGI script.	7215014.cif