Crystallography Open Database

Information card for entry 1512823

Preview

Coordinates	1512823.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C37 H48 N4 Ni2 O9 S2
Calculated formula	C37 H36 N4 Ni2 O9 S2
Title of publication	Polynuclear nickel(II) complexes with salicylaldimine derivative ligands
Authors of publication	Moussa Dieng; Ousmane Diouf; Mohamed Gaye; Abdou Salam Sall; Paulo Perez-Lourido; Laura Valencia; Andrea Caneschi; Lorenzo Sorace
Journal of publication	Inorganica Chimica Acta
Year of publication	2013
Journal volume	394
Pages of publication	741 - 746
a	13.8664 ± 0.0018 Å
b	14.8691 ± 0.0019 Å
c	21.014 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	4332.7 ± 1 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	60
Hermann-Mauguin space group symbol	P b c n
Hall space group symbol	-P 2n 2ab
Residual factor for all reflections	0.0906
Residual factor for significantly intense reflections	0.0672
Weighted residual factors for significantly intense reflections	0.2205
Weighted residual factors for all reflections included in the refinement	0.2586
Goodness-of-fit parameter for all reflections included in the refinement	1.1
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176729 (current)	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1.	1512823.cif
120071	2014-07-11	Adding DOIs to range 1 structures.	1512823.cif
90967	2013-11-21	cif/ Adding structures of 1512823 via cif-deposit CGI script.	1512823.cif