Crystallography Open Database

Information card for entry 4342657

Preview

Coordinates	4342657.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C90 H178 Ce4 Cl12 Cr4 N10 O38
Calculated formula	C85 H166 Ce4 Cl2 Cr4 N10 O38
Title of publication	[In Process Citation].
Authors of publication	Rinck, Julia; Lan, Yanhua; Anson, Christopher E.; Powell, Annie K.
Journal of publication	Inorganic chemistry
Year of publication	2015
Journal volume	54
Journal issue	7
Pages of publication	3107 - 3117
a	15.6834 ± 0.0008 Å
b	16.2908 ± 0.0009 Å
c	29.2873 ± 0.0016 Å
α	79.141 ± 0.001°
β	82.066 ± 0.001°
γ	72.484 ± 0.001°
Cell volume	6981.6 ± 0.7 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0505
Residual factor for significantly intense reflections	0.0434
Weighted residual factors for significantly intense reflections	0.1252
Weighted residual factors for all reflections included in the refinement	0.1297
Goodness-of-fit parameter for all reflections included in the refinement	1.094
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
179529 (current)	2016-03-24	cif/4/34/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/34/26.	4342657.cif
138089	2015-06-05	cif/ Updating files of 4342656, 4342657, 4342658, 4342659, 4342660, 4342661, 4342662, 4342663, 4342664, 4342665, 4342666 Original log message: Adding full bibliography for 4342656--4342666.cif.	4342657.cif
133780	2015-03-11	cif/ Adding structures of 4342656, 4342657, 4342658, 4342659, 4342660, 4342661, 4342662, 4342663, 4342664, 4342665, 4342666 via cif-deposit CGI script.	4342657.cif