Crystallography Open Database

Information card for entry 7054783

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Coordinates	7054783.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C15 H16 Cl Cu N3 O4
Calculated formula	C15 H16 Cl Cu N3 O4
Title of publication	Methyl-substituted enhancement of antitumor activity in square-planar metal complex and analysis of ΔE, ΔG, CV, UV-vis and luminescence
Authors of publication	Zhang, WeiChuan; Lu, Xiaoming; Wang, Guo; Cheng, Yifeng; Zhang, Bo
Journal of publication	New J. Chem.
Year of publication	2015
Journal volume	39
Journal issue	6
Pages of publication	4869
a	7.2802 ± 0.0007 Å
b	11.725 ± 0.001 Å
c	11.8101 ± 0.0012 Å
α	119.471 ± 0.002°
β	101.922 ± 0.001°
γ	91.086 ± 0.001°
Cell volume	850.09 ± 0.14 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 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	0.0412
Residual factor for significantly intense reflections	0.0358
Weighted residual factors for significantly intense reflections	0.0915
Weighted residual factors for all reflections included in the refinement	0.0948
Goodness-of-fit parameter for all reflections included in the refinement	1.136
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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