Crystallography Open Database

Information card for entry 1564976

Preview

Coordinates	1564976.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H16 N2 Ni O5
Calculated formula	C16 H16 N2 Ni O5
SMILES	[Ni]123Oc4cc(ccc4C=[N]1CC[N]2=Cc1ccc(O)cc1O3)O.O
Title of publication	Synthesis, crystal structure, and characterization of two Cu(II) and Ni(II) complexes of a tetradentate N2O2 Schiff base ligand and their application in fabrication of a hydrazine electrochemical sensor
Authors of publication	Hosseinzadeh Sanatkar, Tahereh; Khorshidi, Alireza; Sohouli, Esmail; Janczak, Jan
Journal of publication	Inorganica Chimica Acta
Year of publication	2020
Journal volume	506
Pages of publication	119537
a	19.5243 ± 0.0008 Å
b	18.6443 ± 0.0007 Å
c	10.1928 ± 0.0004 Å
α	90°
β	102.048 ± 0.003°
γ	90°
Cell volume	3628.6 ± 0.3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 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	0.0538
Residual factor for significantly intense reflections	0.0373
Weighted residual factors for significantly intense reflections	0.0875
Weighted residual factors for all reflections included in the refinement	0.0939
Goodness-of-fit parameter for all reflections included in the refinement	1.029
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
269998 (current)	2021-10-18	cif/ Adding structures of 1564976 via cif-deposit CGI script.	1564976.cif