Crystallography Open Database

Information card for entry 1573925

Preview

Coordinates	1573925.cif
Original IUCr paper	HTML

Structure parameters

Common name	Bis{4-(allyloxy)-<i>N</i>'-[4-(octyloxy)benzylidene]benzohydrazidato}nickel(II)
Chemical name	Bis(<i>N</i>'-{[4-(octyloxy)phenyl]methylidene}-4-(prop-2-en-1-yloxy)benzohydrazidato)nickel(II)
Formula	C50 H62 N4 Ni O6
Calculated formula	C50 H62 N4 Ni O6
Title of publication	Bis{4-(allyloxy)-N′-[4-(octyloxy)benzylidene]benzohydrazidato}nickel(II)
Authors of publication	Khan, Sultana Shakila; Howlader, Md. Belayet Hossain; Sheikh, Md. Chanmiya; Miyatake, Ryuta; Zangrando, Ennio
Journal of publication	IUCrData
Year of publication	2025
Journal volume	10
Journal issue	2
a	5.5532 ± 0.0003 Å
b	12.0594 ± 0.0005 Å
c	17.023 ± 0.0008 Å
α	86.599 ± 0.006°
β	83.723 ± 0.006°
γ	82.426 ± 0.006°
Cell volume	1122.11 ± 0.1 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0661
Residual factor for significantly intense reflections	0.0441
Weighted residual factors for significantly intense reflections	0.0871
Weighted residual factors for all reflections included in the refinement	0.0944
Goodness-of-fit parameter for all reflections included in the refinement	1.018
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
297755 (current)	2025-02-15	cif/ Adding structures of 1573925 via cif-deposit CGI script.	1573925.cif