Crystallography Open Database

Information card for entry 4342661

Preview

Coordinates	4342661.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C57 H124.5 Cl2 Cr3 Ho3 N4.5 O27.5
Calculated formula	C57 H115 Cl2 Cr3 Ho3 N4.5 O27.5
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	15.7404 ± 0.0008 Å
b	16.2104 ± 0.0008 Å
c	19.6147 ± 0.001 Å
α	107.23 ± 0.001°
β	102.43 ± 0.001°
γ	109.87 ± 0.001°
Cell volume	4208.4 ± 0.4 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	7
Space group number	1
Hermann-Mauguin space group symbol	P 1
Hall space group symbol	P 1
Residual factor for all reflections	0.0268
Residual factor for significantly intense reflections	0.0256
Weighted residual factors for significantly intense reflections	0.0662
Weighted residual factors for all reflections included in the refinement	0.0668
Goodness-of-fit parameter for all reflections included in the refinement	1.043
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.	4342661.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.	4342661.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.	4342661.cif