Crystallography Open Database

Information card for entry 4109966

Preview

Coordinates	4109966.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C198 H186 Cl8 Ir2 N8 O4
Calculated formula	C198 H186 Cl8 Ir2 N8 O4
Title of publication	Hosting Fullerenes by Dynamic Bond Formation with an Iridium Porphyrin Cyclic Dimer: A "Chemical Friction" for Rotary Guest Motions
Authors of publication	Makoto Yanagisawa; Kentaro Tashiro; Mikio Yamasaki; Takuzo Aida
Journal of publication	Journal of the American Chemical Society
Year of publication	2007
Journal volume	129
Pages of publication	11912 - 11913
a	18.048 ± 0.002 Å
b	30.881 ± 0.004 Å
c	28.104 ± 0.004 Å
α	90°
β	96.9055 ± 0.0017°
γ	90°
Cell volume	15550 ± 3 Å³
Cell temperature	93.1 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 significantly intense reflections	0.0452
Weighted residual factors for all reflections included in the refinement	0.1184
Goodness-of-fit parameter for all reflections included in the refinement	1.103
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
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4109966.cif
120076	2014-07-11	Adding DOIs to range 4/10 structures.	4109966.cif
58745	2012-05-30	cif/ Adding structures of 4109966 via cif-deposit CGI script.	4109966.cif