Crystallography Open Database

Information card for entry 4503144

Preview

Coordinates	4503144.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H25 Cd Cl0 N O6
Calculated formula	C18 H25 Cd N O6
Title of publication	Amine-Templated Assembly of Metal‒Organic Frameworks with Attractive Topologies
Authors of publication	Fang, Qianrong; Zhu, Guangshan; Xue, Ming; Wang, Zhuopeng; Sun, Jinyu; Qiu, Shilun
Journal of publication	Crystal Growth & Design
Year of publication	2008
Journal volume	8
Journal issue	1
Pages of publication	319
a	10.0355 ± 0.0005 Å
b	12.819 ± 0.0006 Å
c	15.4797 ± 0.0007 Å
α	90°
β	102.486 ± 0.001°
γ	90°
Cell volume	1944.29 ± 0.16 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0305
Residual factor for significantly intense reflections	0.029
Weighted residual factors for significantly intense reflections	0.0872
Weighted residual factors for all reflections included in the refinement	0.0889
Goodness-of-fit parameter for all reflections included in the refinement	1
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
179562 (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 4/50/31.	4503144.cif
120110	2014-07-12	Adding DOIs to range 4/50 structures.	4503144.cif
41379	2012-03-13	../uploads/cif-deposit/cod/cif Adding structures of 4503144 via cif-deposit CGI script.	4503144.cif