Crystallography Open Database

Information card for entry 2022640

2022639 << 2022640 >> 2022641

Preview

Coordinates	2022640.cif
Structure factors	2022640.hkl
Original IUCr paper	HTML

Structure parameters

Chemical name	Dichlorido[<i>N</i>,<i>N</i>'-(cyclohexane-1,2-diylidene)bis(4-fluorobenzohydrazide)-κ^2^<i>N</i>',<i>O</i>]zinc(II)
Formula	C20 H18 Cl2 F2 N4 O2 Zn
Calculated formula	C20 H18 Cl2 F2 N4 O2 Zn
SMILES	[Zn]1(Cl)(Cl)[O]=C(N[N]1=C1/C(=N/NC(=O)c2ccc(F)cc2)CCCC1)c1ccc(F)cc1
Title of publication	Two new zinc(II) and mercury(II) complexes based on N,N'-(cyclohexane-1,2-diylidene)bis(4-fluorobenzohydrazide): synthesis, crystal structures and antibacterial activities
Authors of publication	OmarAli, Al-Ameen Bariz; Al-Karawi, Ahmed Jasim M.; Awad, Adil A.; Dege, Necmi; Kansız, Sevgi; Agar, Erbil; Hussein, Zaman Ahmed; Mohammed, Iman Rajab
Journal of publication	Acta Crystallographica, Section C: Structural Chemistry
Year of publication	2020
Journal volume	76
Journal issue	5
Pages of publication	476 - 482
a	9.7682 ± 0.0005 Å
b	17.3071 ± 0.0007 Å
c	13.3524 ± 0.0007 Å
α	90°
β	105.165 ± 0.004°
γ	90°
Cell volume	2178.74 ± 0.19 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.1236
Residual factor for significantly intense reflections	0.0773
Weighted residual factors for significantly intense reflections	0.1778
Weighted residual factors for all reflections included in the refinement	0.1988
Goodness-of-fit parameter for all reflections included in the refinement	1.032
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

Version history

Revision	Date	Message	Files
276706 (current)	2022-07-07	cif/ hkl/ Adding structures of 2022640 via cif-deposit CGI script.	2022640.cif 2022640.hkl