Crystallography Open Database

Information card for entry 4320956

4320955 << 4320956 >> 4320957

Preview

Coordinates	4320956.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C37 H35 Cd3 Cl N6 O17
Calculated formula	C33.5 H20 Cd3 N5 O11.5
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	12.0495 ± 0.0002 Å
b	12.2773 ± 0.0002 Å
c	19.1028 ± 0.0004 Å
α	91.669 ± 0.001°
β	96.85 ± 0.001°
γ	117.945 ± 0.001°
Cell volume	2466.97 ± 0.08 Å³
Cell temperature	198 ± 2 K
Ambient diffraction temperature	198 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1499
Residual factor for significantly intense reflections	0.1079
Weighted residual factors for significantly intense reflections	0.2799
Weighted residual factors for all reflections included in the refinement	0.3078
Goodness-of-fit parameter for all reflections included in the refinement	1.835
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.	4320956.cif
120105	2014-07-12	Adding DOIs to range 4/32 structures.	4320956.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4320956.cif
18278	2011-04-28	../uploads/cif-deposit/cod/cif Adding structures of 4320956 via cif-deposit CGI script.	4320956.cif