Crystallography Open Database

Information card for entry 7709986

Preview

Coordinates	7709986.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H30 Cl2 N4 Ni O6
Calculated formula	C32 H30 Cl2 N4 Ni O6
SMILES	[Ni]123(Oc4c5[n]3cccc5c(Cl)cc4)(Oc3c4[n]2cccc4c(Cl)cc3)[n]2c(c3[n]1ccc(OC)c3)cc(OC)cc2.OC.OC
Title of publication	A new class of nickel(II) oxyquinoline-bipyridine complexes as potent anticancer agents induces apoptosis and autophagy in A549/DDP tumor cells through mitophagy pathways
Authors of publication	Wang, Zhen-Feng; Wei, Qiao-Chang; Li, Jin-Xian; Zhou, Zhen; Zhang, Shuhua
Journal of publication	Dalton Transactions
Year of publication	2022
a	10.482 ± 0.002 Å
b	11.84 ± 0.003 Å
c	14.351 ± 0.003 Å
α	89.092 ± 0.007°
β	72.122 ± 0.007°
γ	69.927 ± 0.007°
Cell volume	1584.1 ± 0.6 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0676
Residual factor for significantly intense reflections	0.0433
Weighted residual factors for significantly intense reflections	0.0978
Weighted residual factors for all reflections included in the refinement	0.1078
Goodness-of-fit parameter for all reflections included in the refinement	1.028
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
274459 (current)	2022-04-12	cif/ Adding structures of 7709968, 7709969, 7709970, 7709971, 7709972, 7709973, 7709974, 7709975, 7709976, 7709977, 7709978, 7709979, 7709980, 7709981, 7709982, 7709983, 7709984, 7709985, 7709986, 7709987, 7709988, 7709989 via cif-deposit CGI script.	7709986.cif