Crystallography Open Database

Information card for entry 7054782

Preview

Coordinates	7054782.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C17 H20 Cu N4 O7
Calculated formula	C17 H20 Cu N4 O7
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	7.395 ± 0.0008 Å
b	10.783 ± 0.0011 Å
c	12.36 ± 0.0014 Å
α	102.279 ± 0.001°
β	90.428 ± 0.001°
γ	106.08 ± 0.002°
Cell volume	923.05 ± 0.17 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1552
Residual factor for significantly intense reflections	0.121
Weighted residual factors for significantly intense reflections	0.2882
Weighted residual factors for all reflections included in the refinement	0.325
Goodness-of-fit parameter for all reflections included in the refinement	1.028
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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