Crystallography Open Database

Information card for entry 4506512

Preview

Coordinates	4506512.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H32 Cd3 N2 O16
Calculated formula	C36 H32 Cd3 N2 O16
Title of publication	Solvent-Dependent Formation of Cd(II) Coordination Polymers Based on aC2-Symmetric Tricarboxylate Linker
Authors of publication	Li, Lina; Wang, Shuyun; Chen, Tianliang; Sun, Zhihua; Luo, Junhua; Hong, Maochun
Journal of publication	Crystal Growth & Design
Year of publication	2012
Journal volume	12
Journal issue	8
Pages of publication	4109
a	7.8733 ± 0.00001 Å
b	10.1432 ± 0.00001 Å
c	13.528 Å
α	68.355 ± 0.012°
β	79.645 ± 0.016°
γ	70.702 ± 0.014°
Cell volume	945.69 ± 0.11 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	0.0724
Residual factor for significantly intense reflections	0.0668
Weighted residual factors for significantly intense reflections	0.1735
Weighted residual factors for all reflections included in the refinement	0.1757
Goodness-of-fit parameter for all reflections included in the refinement	1.21
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
179601 (current)	2016-03-24	cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/65.	4506512.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4506512.cif
66199	2012-09-09	cif/ Adding structures of 4506512 via cif-deposit CGI script.	4506512.cif