Crystallography Open Database

Information card for entry 7050515

Preview

Coordinates	7050515.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C81.5 H74 Ag3 Cl3 N18 O15.5
Calculated formula	C81.5 H74 Ag3 Cl3 N18 O15.5
Title of publication	A case of four-coordinate silver(i) adopting a high energy planar geometry. Experiment and theory
Authors of publication	Chowdhury, Shubhamoy; Drew, Michael G. B.; Datta, Dipankar
Journal of publication	New Journal of Chemistry
Year of publication	2003
Journal volume	27
Journal issue	5
Pages of publication	831
a	26.66 ± 0.04 Å
b	15.4 ± 0.02 Å
c	21.64 ± 0.03 Å
α	90°
β	90.06°
γ	90°
Cell volume	8885 ± 2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	5
Hermann-Mauguin space group symbol	C 1 2 1
Hall space group symbol	C 2y
Residual factor for all reflections	0.0897
Residual factor for significantly intense reflections	0.0684
Weighted residual factors for significantly intense reflections	0.1867
Weighted residual factors for all reflections included in the refinement	0.2069
Goodness-of-fit parameter for all reflections included in the refinement	1
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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