Crystallography Open Database

Information card for entry 1564084

Preview

Coordinates	1564084.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10 H10 Cl N4 O4 Zn
Calculated formula	C12.6316 Cl0.210526 N2.52632 Zn0.421053
Title of publication	Complexes based N,N-donors (2,2′-bipyridyl & 2-(2-aminophenyl)benzimidazole); Synthesis, characterization, DNA interaction and toxicity assessment against Chlorella vulgaris microchlorophyte; X-ray crystal structure of [Zn(bpy)3)]Cl2
Authors of publication	Annan, Neveen A.; Butler, Ian S.; Osman, Yehia A.; Hussein, Mervat H.; Jean-Claude, Bertrand J.; Saad, Eman M.; Mostafa, Sahar I.
Journal of publication	Inorganica Chimica Acta
Year of publication	2020
Journal volume	512
Pages of publication	119885
a	23.654 ± 0.003 Å
b	22.295 ± 0.002 Å
c	13.6451 ± 0.0014 Å
α	90°
β	73.421 ± 0.003°
γ	90°
Cell volume	6896.8 ± 1.3 Å³
Cell temperature	130 ± 2 K
Ambient diffraction temperature	130 ± 2 K
Number of distinct elements	6
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/n 1
Hall space group symbol	-P 2yac
Residual factor for all reflections	0.3302
Residual factor for significantly intense reflections	0.2564
Weighted residual factors for significantly intense reflections	0.614
Weighted residual factors for all reflections included in the refinement	0.6364
Goodness-of-fit parameter for all reflections included in the refinement	3.83
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
267425 (current)	2021-07-09	cif/ Adding structures of 1564084 via cif-deposit CGI script.	1564084.cif