Crystallography Open Database

Information card for entry 4503562

Preview

Coordinates	4503562.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C35 H26 Cd2 N4 O10
Calculated formula	C35 H26 Cd2 N4 O10
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	12.242 ± 0.002 Å
b	12.5584 ± 0.0019 Å
c	13.0368 ± 0.0018 Å
α	65.302 ± 0.008°
β	89.321 ± 0.01°
γ	68.863 ± 0.009°
Cell volume	1675.5 ± 0.5 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	0.0504
Residual factor for significantly intense reflections	0.0374
Weighted residual factors for significantly intense reflections	0.1071
Weighted residual factors for all reflections included in the refinement	0.1155
Goodness-of-fit parameter for all reflections included in the refinement	1.002
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
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.	4503562.cif
120110	2014-07-12	Adding DOIs to range 4/50 structures.	4503562.cif
41629	2012-03-13	../uploads/cif-deposit/cod/cif Adding structures of 4503562 via cif-deposit CGI script.	4503562.cif