Crystallography Open Database

Information card for entry 4320957

4320956 << 4320957 >> 4320958

Preview

Coordinates	4320957.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C73 H62 Cd6 Cl N12 O30
Calculated formula	C69.5 H44 Cd6 Cl N11 O27
Title of publication	Pillared, 3D Metal-Organic Frameworks with Rectangular Channels. Synthesis and Characterization of Coordination Polymers Based on Tricadmium Carboxylates
Authors of publication	Owen R. Evans; Wenbin Lin
Journal of publication	Inorganic Chemistry
Year of publication	2000
Journal volume	39
Pages of publication	2189 - 2198
a	19.0382 ± 0.0003 Å
b	23.8341 ± 0.0004 Å
c	21.7556 ± 0.0003 Å
α	90°
β	97.58°
γ	90°
Cell volume	9785.5 ± 0.3 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.1031
Residual factor for significantly intense reflections	0.0505
Weighted residual factors for significantly intense reflections	0.1563
Weighted residual factors for all reflections included in the refinement	0.1787
Goodness-of-fit parameter for all reflections included in the refinement	1.06
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179312 (current)	2016-03-23	cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/09.	4320957.cif
120105	2014-07-12	Adding DOIs to range 4/32 structures.	4320957.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4320957.cif
18279	2011-04-28	../uploads/cif-deposit/cod/cif Adding structures of 4320957 via cif-deposit CGI script.	4320957.cif