Crystallography Open Database

Information card for entry 4107196

Preview

Coordinates	4107196.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C216 H176 F24 N8 O40 Ru8 S8
Calculated formula	C216 H176 F24 N8 O40 Ru8 S8
Title of publication	A Unique Non-catenane Interlocked Self-Assembled Supramolecular Architecture and Its Photophysical Properties
Authors of publication	Vaishali Vajpayee; Young Ho Song; Timothy R. Cook; Hyunuk Kim; Youngil Lee; Peter J. Stang; Ki-Whan Chi
Journal of publication	Journal of the American Chemical Society
Year of publication	2011
Journal volume	133
Pages of publication	19646 - 19649
a	21.535 ± 0.004 Å
b	22.948 ± 0.005 Å
c	25.314 ± 0.005 Å
α	97.01 ± 0.03°
β	101.86 ± 0.03°
γ	92.81 ± 0.03°
Cell volume	12116 ± 5 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1198
Residual factor for significantly intense reflections	0.0939
Weighted residual factors for significantly intense reflections	0.2812
Weighted residual factors for all reflections included in the refinement	0.3001
Goodness-of-fit parameter for all reflections included in the refinement	1.209
Diffraction radiation wavelength	0.9 Å
Diffraction radiation type	synchrotron
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
178817 (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 4/10/71.	4107196.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4107196.cif
54848	2012-04-30	cif/ Adding structures of 4107196 via cif-deposit CGI script.	4107196.cif