Crystallography Open Database

Information card for entry 7031050

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Coordinates	7031050.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C69 H72 Ag2 F12 N12 O Sb2
Calculated formula	C63 H62 Ag2 F12 N12 O Sb2
Title of publication	Cu(i) and Ag(i) complexes of 7,10-bis-N-heterocycle-diazafluoranthenes: programmed molecular grids?
Authors of publication	Rahanyan, Nelli; Duttwyler, Simon; Linden, Anthony; Baldridge, Kim K.; Siegel, Jay S.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2014
Journal volume	43
Journal issue	28
Pages of publication	11027 - 11038
a	23.2507 ± 0.0003 Å
b	17.266 ± 0.0003 Å
c	17.649 ± 0.0003 Å
α	90°
β	91.7458 ± 0.001°
γ	90°
Cell volume	7081.84 ± 0.19 Å³
Cell temperature	160 ± 1 K
Ambient diffraction temperature	160 ± 1 K
Number of distinct elements	7
Space group number	12
Hermann-Mauguin space group symbol	C 1 2/m 1
Hall space group symbol	-C 2y
Residual factor for all reflections	0.0545
Residual factor for significantly intense reflections	0.0456
Weighted residual factors for significantly intense reflections	0.1114
Weighted residual factors for all reflections included in the refinement	0.1161
Goodness-of-fit parameter for all reflections included in the refinement	1.08
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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