Crystallography Open Database

Information card for entry 7057637

Preview

Coordinates	7057637.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H53 Cl F2 N10 O12 S Zn
Calculated formula	C48 H53 Cl F2 N10 O12 S Zn
Title of publication	New model of metalloantibiotic: synthesis, structure and biological activity of a zinc(ii) mononuclear complex carrying two enrofloxacin and sulfadiazine antibiotics
Authors of publication	Boughougal, Amina; Cherchali, Fatma Zohra; Messai, Amel; Attik, Nina; Decoret, Dominique; Hologne, Maggy; Sanglar, Corinne; Pilet, Guillaume; Tommasino, Jean Bernard; Luneau, Dominique
Journal of publication	New Journal of Chemistry
Year of publication	2018
Journal volume	42
Journal issue	18
Pages of publication	15346
a	12.6714 ± 0.0006 Å
b	14.1042 ± 0.0007 Å
c	15.0668 ± 0.0007 Å
α	68.569 ± 0.005°
β	81.395 ± 0.004°
γ	77.993 ± 0.004°
Cell volume	2443.7 ± 0.2 Å³
Cell temperature	293 K
Ambient diffraction temperature	293 K
Number of distinct elements	8
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1241
Residual factor for significantly intense reflections	0.11
Weighted residual factors for all reflections	0.1012
Weighted residual factors for significantly intense reflections	0.0979
Weighted residual factors for all reflections included in the refinement	0.0938
Goodness-of-fit parameter for all reflections included in the refinement	1.0228
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
230486 (current)	2019-11-17	cif/ Updating files of 7057636, 7057637 Original log message: Adding full bibliography for 7057636--7057637.cif.	7057637.cif
209537	2018-08-10	cif/ Adding structures of 7057636, 7057637 via cif-deposit CGI script.	7057637.cif