Crystallography Open Database

Information card for entry 4103191

Preview

Coordinates	4103191.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	08104
Formula	C85 H56 B Cu F24 N2 O P2
Calculated formula	C85 H56 B Cu F24 N2 O P2
Title of publication	Oxygen Gas Sensing by Luminescence Quenching in Crystals of Cu(xantphos)(phen)+ Complexes
Authors of publication	Conor S. Smith; Charles W. Branham; Brian J. Marquardt; Kent R. Mann
Journal of publication	Journal of the American Chemical Society
Year of publication	2010
Journal volume	132
Pages of publication	14079 - 14085
a	15.289 ± 0.002 Å
b	16.539 ± 0.002 Å
c	17.019 ± 0.002 Å
α	102.685 ± 0.002°
β	108.556 ± 0.002°
γ	97.253 ± 0.002°
Cell volume	3889.7 ± 0.8 Å³
Cell temperature	123 ± 2 K
Ambient diffraction temperature	123 ± 2 K
Number of distinct elements	8
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0578
Residual factor for significantly intense reflections	0.038
Weighted residual factors for significantly intense reflections	0.092
Weighted residual factors for all reflections included in the refinement	0.1052
Goodness-of-fit parameter for all reflections included in the refinement	1.015
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
178777 (current)	2016-03-21	cif/4/10/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/10/31.	4103191.cif
120076	2014-07-11	Adding DOIs to range 4/10 structures.	4103191.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4103191.cif
26149	2011-09-19	../uploads/cif-deposit/cod/cif Adding structures of 4103191 via cif-deposit CGI script.	4103191.cif