Crystallography Open Database

Information card for entry 7111608

Preview

Coordinates	7111608.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C23 H44 Cu3 N7
Calculated formula	C23 H44 Cu3 N7
Title of publication	Reversible luminescent reaction of amines with copper(i) cyanide
Authors of publication	Ley, Amanda N.; Dunaway, Lars E.; Brewster, Timothy P.; Dembo, Matthew D.; Harris, T. David; Baril-Robert, François; Li, Xiaobo; Patterson, Howard H.; Pike, Robert D.
Journal of publication	Chemical Communications
Year of publication	2010
Journal volume	46
Journal issue	25
Pages of publication	4565 - 4567
a	26.3331 ± 0.0002 Å
b	5.2292 ± 0.0001 Å
c	23.7064 ± 0.0002 Å
α	90°
β	122.678 ± 0.0003°
γ	90°
Cell volume	2747.69 ± 0.06 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	4
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	0.0229
Residual factor for significantly intense reflections	0.0212
Weighted residual factors for significantly intense reflections	0.0582
Weighted residual factors for all reflections included in the refinement	0.0594
Goodness-of-fit parameter for all reflections included in the refinement	1.016
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
180230 (current)	2016-03-26	cif/7/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/11/16.	7111608.cif
96699	2014-01-29	cif/ Adding structures of 7111608, 7111609, 7111610, 7111611, 7111612, 7111613 via cif-deposit CGI script.	7111608.cif