Crystallography Open Database

Information card for entry 4342658

Preview

Coordinates	4342658.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C91 H178.1 Cl14 Cr4 N9.7 Nd4 O37.1
Calculated formula	C86 H168.1 Cl4 Cr4 N9.7 Nd4 O37.1
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	15.6412 ± 0.0012 Å
b	16.349 ± 0.0012 Å
c	29.309 ± 0.002 Å
α	79.574 ± 0.001°
β	81.92 ± 0.001°
γ	72.457 ± 0.001°
Cell volume	6998.6 ± 0.9 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	0.0704
Residual factor for significantly intense reflections	0.0603
Weighted residual factors for significantly intense reflections	0.1528
Weighted residual factors for all reflections included in the refinement	0.1581
Goodness-of-fit parameter for all reflections included in the refinement	1.064
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.	4342658.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.	4342658.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.	4342658.cif