Crystallography Open Database

Information card for entry 7240748

Preview

Coordinates	7240748.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	MetZn
Formula	C4 H12 Cl3 N5 Zn
Calculated formula	C4 H12 Cl3 N5 Zn
SMILES	[Zn](Cl)(Cl)(Cl)[N](=C(N)N(C)C)C(=[NH2+])N
Title of publication	Biguanide‒transition metals complexes as potential drug for hyperglycemia treatment
Authors of publication	Villamizar-Delgado, Stephanny; Porras-Osorio, Laura M.; Piñeros, Octavio; Ellena, Javier; Balcazar, Norman; Varela-Miranda, Ruben E.; D'Vries, Richard F.
Journal of publication	RSC Advances
Year of publication	2020
Journal volume	10
Journal issue	38
Pages of publication	22856 - 22863
a	12.52 ± 0.0012 Å
b	7.514 ± 0.0006 Å
c	13.0298 ± 0.0013 Å
α	90°
β	113.199 ± 0.012°
γ	90°
Cell volume	1126.7 ± 0.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
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	0.0553
Residual factor for significantly intense reflections	0.0373
Weighted residual factors for significantly intense reflections	0.0823
Weighted residual factors for all reflections included in the refinement	0.0928
Goodness-of-fit parameter for all reflections included in the refinement	1.09
Diffraction radiation probe	x-ray
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
258140 (current)	2020-10-06	cif/ Updating files of 7240746, 7240747, 7240748, 7240749 Original log message: Adding full bibliography for 7240746--7240749.cif.	7240748.cif
253200	2020-06-17	cif/ Adding structures of 7240746, 7240747, 7240748, 7240749 via cif-deposit CGI script.	7240748.cif