Crystallography Open Database

Information card for entry 7015468

Preview

Coordinates	7015468.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C35 H42 Cl F6 Ir N3 O12 P
Calculated formula	C35 H42 Cl F6 Ir N3 O12 P
Title of publication	Unprecedented diastereoselective generation of chiral-at-metal, half sandwich Ir(III) and Rh(III) complexes via anomeric isomerism on "sugar-coated" N-heterocyclic carbene ligands.
Authors of publication	Shibata, Teppei; Hashimoto, Hideki; Kinoshita, Isamu; Yano, Shigenobu; Nishioka, Takanori
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2011
Journal volume	40
Journal issue	18
Pages of publication	4826 - 4829
a	12.6224 ± 0.0013 Å
b	15.2989 ± 0.0018 Å
c	22.254 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	4297.4 ± 0.9 Å³
Cell temperature	193.1 K
Number of distinct elements	8
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for significantly intense reflections	0.0455
Weighted residual factors for all reflections included in the refinement	0.0968
Goodness-of-fit parameter for all reflections included in the refinement	1.002
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176453 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7015468.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7015468.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7015468.cif
21160	2011-06-21	../uploads/cif-deposit/cod/cif Adding structures of 7015468, 7015469 via cif-deposit CGI script.	7015468.cif