Crystallography Open Database

Information card for entry 7235881

Preview

Coordinates	7235881.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C50 H45 Cd2 N9 O13
Calculated formula	C50 H45 Cd2 N9 O13
Title of publication	Unique topological motifs in two Cd(ii)-coordination polymers: mutual-embedded 2D bilayers, 3D polythreaded structures, self-penetrated networks and 2D →2D interpenetrated homochiral bilayers
Authors of publication	Xu, Guo-Wang; Wu, Ya-Pan; Wang, Hai-Bing; Wang, Ye-Nan; Li, Dong-Sheng; Liu, Yun-Ling
Journal of publication	CrystEngComm
Year of publication	2015
Journal volume	17
Journal issue	47
Pages of publication	9055
a	17.624 ± 0.0011 Å
b	11.8156 ± 0.0007 Å
c	26.146 ± 0.0013 Å
α	90°
β	116.317 ± 0.003°
γ	90°
Cell volume	4880.3 ± 0.5 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0423
Residual factor for significantly intense reflections	0.0345
Weighted residual factors for significantly intense reflections	0.0872
Weighted residual factors for all reflections included in the refinement	0.0919
Goodness-of-fit parameter for all reflections included in the refinement	1.02
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
233422 (current)	2019-11-23	cif/ Adding structures of 7235881, 7235882 via cif-deposit CGI script.	7235881.cif