Crystallography Open Database

Information card for entry 7024942

Preview

Coordinates	7024942.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H30 Cl2 N4 Ni2 O18
Calculated formula	C22 H30 Cl2 N4 Ni2 O18
Title of publication	Structural, electrochemical, phosphate-hydrolysis, DNA binding and cleavage studies of new macrocyclic binuclear nickel(II) complexes.
Authors of publication	Anbu, Sellamuthu; Kandaswamy, Muthusamy; Varghese, Babu
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2010
Journal volume	39
Journal issue	16
Pages of publication	3823 - 3832
a	8.978 ± 0.002 Å
b	12.042 ± 0.002 Å
c	14.186 ± 0.002 Å
α	90 ± 0.005°
β	90.981 ± 0.01°
γ	90 ± 0.005°
Cell volume	1533.5 ± 0.5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0624
Residual factor for significantly intense reflections	0.0415
Weighted residual factors for significantly intense reflections	0.112
Weighted residual factors for all reflections included in the refinement	0.1237
Goodness-of-fit parameter for all reflections included in the refinement	1.05
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179954 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/49.	7024942.cif
92756	2014-01-12	cif/ Adding structures of 7024942 via cif-deposit CGI script.	7024942.cif