Crystallography Open Database

Information card for entry 7038909

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Coordinates	7038909.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C6 H4 Cu N O2
Calculated formula	C6 H4 Cu N O2
Title of publication	A 3-D net based on weak metallophilic (CuCu) interactions.
Authors of publication	Zhou, Jian; Tan, Xiaofeng; Hu, Feilong; Zou, Hua-Hong; Almeida Paz, Filipe A.; Fu, Lianshe; Zhao, Rongqing
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2016
Journal volume	45
Journal issue	28
Pages of publication	11292 - 11296
a	12.8325 ± 0.0008 Å
b	26.6088 ± 0.0014 Å
c	7.2481 ± 0.0004 Å
α	90°
β	90°
γ	90°
Cell volume	2474.9 ± 0.2 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	43
Hermann-Mauguin space group symbol	F d d 2
Hall space group symbol	F 2 -2d
Residual factor for all reflections	0.0489
Residual factor for significantly intense reflections	0.0407
Weighted residual factors for significantly intense reflections	0.0789
Weighted residual factors for all reflections included in the refinement	0.0875
Goodness-of-fit parameter for all reflections included in the refinement	1.069
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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