Crystallography Open Database

Information card for entry 7050426

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Coordinates	7050426.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H28 Ag Cl N6 O6
Calculated formula	C28 H24 Ag Cl N6 O5.98
Title of publication	A novel copper(i) complex that is a monomeric single helix in solid state but a dimeric double helix in solution
Authors of publication	Chowdhury, Shubhamoy; Iveson, Peter B.; Drew, Michael G. B.; Tocher, Derek A.; Datta, Dipankar
Journal of publication	New Journal of Chemistry
Year of publication	2003
Journal volume	27
Journal issue	2
Pages of publication	193
a	28.01 ± 0.04 Å
b	15.3 ± 0.02 Å
c	20.37 ± 0.03 Å
α	90°
β	127.937 ± 0.01°
γ	90°
Cell volume	6885 ± 17 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.1298
Residual factor for significantly intense reflections	0.0756
Weighted residual factors for significantly intense reflections	0.2224
Weighted residual factors for all reflections included in the refinement	0.2586
Goodness-of-fit parameter for all reflections included in the refinement	1.017
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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