Crystallography Open Database

Information card for entry 8102087

8102086 << 8102087 >> 8102088

Preview

Coordinates	8102087.cif

Structure parameters

Chemical name	(1,10-phenanthroline-N,N')-bis(2-fluorobenzoato)-cadmium(II)
Formula	C52 H32 Cd2 F4 N4 O8
Calculated formula	C52 H32 Cd2 F4 N4 O8
Title of publication	Crystal structure of (1,10-phenanthroline-N,N')-bis(2-fluorobenzoato)- cadmium(II), Cd(C~7~H~4~O~2~F)~2~(C~12~H~8~N~2~)
Authors of publication	Lou, Q.-Z.
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2007
Journal volume	222
Journal issue	2
Pages of publication	105 - 106
a	22.1571 ± 0.0003 Å
b	10.2408 ± 0.0001 Å
c	20.3943 ± 0.0002 Å
α	90°
β	103.867 ± 0.001°
γ	90°
Cell volume	4492.72 ± 0.09 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0453
Residual factor for significantly intense reflections	0.0319
Weighted residual factors for significantly intense reflections	0.0741
Weighted residual factors for all reflections included in the refinement	0.0811
Goodness-of-fit parameter for all reflections included in the refinement	1.082
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
176728 (current)	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 8.	8102087.cif
108257	2014-03-29	cif/8/ (antanas@lokys.ibt.lt) Adding and updating bibliographic information: volume, authors, issue, first page, last page.	8102087.cif
35911	2012-02-28	cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree.	8102087.cif
12826	2011-03-06	../uploads/cif-deposit/cod/cif Adding structures of 8102087 via cif-deposit CGI script.	8102087.cif