Crystallography Open Database

Information card for entry 7020285

7020284 << 7020285 >> 7020286

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Structure parameters

Formula	C24 H30 Dy N5 O15 V
Calculated formula	C24 H30 Dy N5 O15 V
SMILES	[Dy]123456([O]7[V]89([O]1c1c([O]3C)cccc1C=[N]9CC(C[N]8=Cc1c7c([O]2C)ccc1)(C)C)([O]=C(C)C)=O)([O]=N(=O)O4)(ON(=[O]5)=O)ON(=[O]6)=O
Title of publication	Exchange coupling in TbCu and DyCu single-molecule magnets and related lanthanide and vanadium analogs.
Authors of publication	Ishida, Takayuki; Watanabe, Ryo; Fujiwara, Kei; Okazawa, Atsushi; Kojima, Norimichi; Tanaka, Go; Yoshii, Shunsuke; Nojiri, Hiroyuki
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2012
Journal volume	41
Journal issue	44
Pages of publication	13609 - 13619
a	9.909 ± 0.003 Å
b	17.535 ± 0.003 Å
c	18.241 ± 0.009 Å
α	90°
β	105.49 ± 0.004°
γ	90°
Cell volume	3054.3 ± 1.8 Å³
Cell temperature	90 K
Ambient diffraction temperature	90 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for significantly intense reflections	0.0278
Weighted residual factors for all reflections included in the refinement	0.0453
Goodness-of-fit parameter for all reflections included in the refinement	1.016
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
301848 (current)	2025-08-21	Add cross-references to PubChem compounds in COD range 7/02/ Each referenced PubChem compound corresponds to the full crystal structure.	7020285.cif
176453	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7020285.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7020285.cif
71556	2013-01-20	cif/ Adding structures of 7020280, 7020281, 7020282, 7020283, 7020284, 7020285, 7020286, 7020287 via cif-deposit CGI script.	7020285.cif