Crystallography Open Database

Information card for entry 4334263

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Structure parameters

Chemical name	[Eu(CyMe4-BTBP)(NO3)3].toluene
Formula	C46 H54 Eu N11 O9
Calculated formula	C46 H54 Eu N11 O9
Title of publication	Lanthanide Speciation in Potential SANEX and GANEX Actinide/Lanthanide Separations Using Tetra-N-Donor Extractants
Authors of publication	Daniel M. Whittaker; Tamara L. Griffiths; Madeleine Helliwell; Adam N. Swinburne; Louise S. Natrajan; Frank W. Lewis; Laurence M. Harwood; Stephen A. Parry; Clint A. Sharrad
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	3429 - 3444
a	26.385 ± 0.002 Å
b	11.6674 ± 0.0011 Å
c	15.7469 ± 0.0014 Å
α	90°
β	90.673 ± 0.001°
γ	90°
Cell volume	4847.3 ± 0.7 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100.15 K
Number of distinct elements	5
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	0.043
Weighted residual factors for significantly intense reflections	0.1146
Weighted residual factors for all reflections included in the refinement	0.1164
Goodness-of-fit parameter for all reflections included in the refinement	1.143
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
301839 (current)	2025-08-21	Add cross-references to PubChem compounds in COD range 4/33/ Each referenced PubChem compound corresponds to the full crystal structure.	4334263.cif
179445	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/42.	4334263.cif
100080	2014-02-04	cif/ Adding structures of 4334263 via cif-deposit CGI script.	4334263.cif