Crystallography Open Database

Information card for entry 7210604

Preview

Coordinates	7210604.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C60 H46 Cd N12 O24
Calculated formula	C60 H46 Cd N12 O24
Title of publication	A series of entangled ZnII/CdII coordination polymers constructed from 1,3,5-benzenetricarboxylate acid and flexible triazole ligands
Authors of publication	Luo, Yu-Hui; Yue, Feng-Xia; Yu, Xiao-Yang; Gu, Ling-Ling; Zhang, Hong; Chen, Xin
Journal of publication	CrystEngComm
Year of publication	2013
Journal volume	15
Journal issue	40
Pages of publication	8116
a	9.341 ± 0.0004 Å
b	12.5779 ± 0.0006 Å
c	14.0193 ± 0.0005 Å
α	103.842 ± 0.004°
β	105.081 ± 0.003°
γ	99.784 ± 0.004°
Cell volume	1496.11 ± 0.12 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0345
Residual factor for significantly intense reflections	0.0295
Weighted residual factors for significantly intense reflections	0.0658
Weighted residual factors for all reflections included in the refinement	0.0687
Goodness-of-fit parameter for all reflections included in the refinement	1.049
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7210604.html