Crystallography Open Database

Information card for entry 7715380

Preview

Coordinates	7715380.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C68 H73 F4 N16 O16 Yb
Calculated formula	C68 H73 F4 N16 O16 Yb
SMILES	[Yb]1234(OC(=O)C5=CN6N(C)COc7c(N8CCN(C)CC8)c(F)cc(c67)C5=[O]1)(OC(=O)C1=CN5N(C)COc6c5c(cc(F)c6N5CCN(C)CC5)C1=[O]2)(OC(=O)C1=CN2N(C)COc5c(N6CCN(C)CC6)c(F)cc(C1=[O]3)c25)OC(=O)C1=CN2N(C)COc3c(N5CC[NH+](C)CC5)c(F)cc(C1=[O]4)c23
Title of publication	Marbofloxacin combined with heavy rare-earth ions makes better candidates for veterinary drugs: crystal structure and bio-activity studies.
Authors of publication	Chen, Zhi-Chuan; Liu, Rui-Xue; Xie, Yan-Jie; Hu, Qin; Huang, Fu-Ping; Liu, Yan-Cheng; Liang, Hong
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2024
Journal volume	53
Journal issue	9
Pages of publication	4204 - 4213
a	15.1857 ± 0.0007 Å
b	17.7922 ± 0.0009 Å
c	21.4144 ± 0.0009 Å
α	95.404 ± 0.004°
β	108.198 ± 0.004°
γ	112.715 ± 0.005°
Cell volume	4915.5 ± 0.5 Å³
Cell temperature	150 ± 0.1 K
Ambient diffraction temperature	150 ± 0.1 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	0.076
Residual factor for significantly intense reflections	0.0569
Weighted residual factors for significantly intense reflections	0.129
Weighted residual factors for all reflections included in the refinement	0.1383
Goodness-of-fit parameter for all reflections included in the refinement	0.976
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
290064 (current)	2024-03-04	cif/ Adding structures of 7715374, 7715375, 7715376, 7715377, 7715378, 7715379, 7715380, 7715381, 7715382 via cif-deposit CGI script.	7715380.cif