Crystallography Open Database

Information card for entry 4113437

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Coordinates	4113437.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C23 H21 Cu2 N2 O7
Calculated formula	C23 H16 Cu2 N2 O7
Title of publication	Novel Cu(I) Dinuclear Complexes Containing μ2-η2,η2-Type Benzoquinone Ligand
Authors of publication	Shigeyuki Masaoka; George Akiyama; Satoshi Horike; Susumu Kitagawa; Tomohiko Ida; Kazunaka Endo
Journal of publication	Journal of the American Chemical Society
Year of publication	2003
Journal volume	125
Pages of publication	1152 - 1153
a	11.965 ± 0.005 Å
b	7.09 ± 0.002 Å
c	26.6 ± 0.02 Å
α	90°
β	112.783 ± 0.005°
γ	90°
Cell volume	2080.5 ± 1.9 Å³
Cell temperature	293.2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for significantly intense reflections	0.0714
Weighted residual factors for all reflections included in the refinement	0.0917
Goodness-of-fit parameter for all reflections included in the refinement	2.433
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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