Crystallography Open Database

Information card for entry 4080667

Preview

Coordinates	4080667.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C276 H208 F24 Ir4 N8 O11 P12
Calculated formula	C276 H208 F24 Ir4 N8 O11 P12
Title of publication	Enhanced Emission and Analyte Sensing by Cinchonine Iridium(III) Cyclometalated Complexes Bearing Bent Diphosphine Chelators
Authors of publication	Luo, Shao-Xiong; Wei, Lu; Zhang, Xin-Hai; Lim, Min Hwee; Lin, K. X. Vivian; Yeo, M. H. Valerie; Zhang, Wen-Hua; Liu, Zhi-Pan; Young, David J.; Hor, T. S. Andy
Journal of publication	Organometallics
Year of publication	2013
Journal volume	32
Journal issue	10
Pages of publication	2908
a	32.192 ± 0.008 Å
b	11.776 ± 0.003 Å
c	34.595 ± 0.009 Å
α	90°
β	94.986 ± 0.005°
γ	90°
Cell volume	13065 ± 6 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0888
Residual factor for significantly intense reflections	0.0697
Weighted residual factors for significantly intense reflections	0.1899
Weighted residual factors for all reflections included in the refinement	0.2024
Goodness-of-fit parameter for all reflections included in the refinement	1.104
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
178695 (current)	2016-03-21	cif/4/08/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/08/06.	4080667.cif
87259	2013-07-14	cif/ Adding structures of 4080667, 4080668, 4080669, 4080670, 4080671 via cif-deposit CGI script.	4080667.cif