Crystallography Open Database

Information card for entry 4503561

Preview

Coordinates	4503561.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H38 Cd3 O28
Calculated formula	C22 H38 Cd3 O28
Title of publication	Syntheses, Structures, and Photoluminescence of Four d10Metal−Organic Frameworks Constructed from 3,5-Bis-oxyacetate-benzoic Acid
Authors of publication	He, Yin-Hua; Feng, Yun-Long; Lan, You-Zhao; Wen, Yi-Hang
Journal of publication	Crystal Growth & Design
Year of publication	2008
Journal volume	8
Journal issue	10
Pages of publication	3586
a	7.8386 ± 0.0005 Å
b	11.5023 ± 0.0003 Å
c	11.6566 ± 0.0003 Å
α	117.161 ± 0.001°
β	103.249 ± 0.002°
γ	94.302 ± 0.002°
Cell volume	890.4 ± 0.07 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0256
Residual factor for significantly intense reflections	0.0234
Weighted residual factors for significantly intense reflections	0.0716
Weighted residual factors for all reflections included in the refinement	0.0731
Goodness-of-fit parameter for all reflections included in the refinement	1.016
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
179569 (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 4/50/35.	4503561.cif
120110	2014-07-12	Adding DOIs to range 4/50 structures.	4503561.cif
41628	2012-03-13	../uploads/cif-deposit/cod/cif Adding structures of 4503561 via cif-deposit CGI script.	4503561.cif