Crystallography Open Database

Information card for entry 7116030

Preview

Coordinates	7116030.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	{Rh2(O2CCH3)4N(CH2CH2)2NC60}nnC602nCS2
Chemical name	(2) at 180K
Formula	C134 H20 N2 O8 Rh2 S4
Calculated formula	C134 H20 N2 O8 Rh2 S4
Title of publication	Zipping up fullerenes into polymers using rhodium(II) acetate dimer and N(CH2CH2)2NC60 as building blocks
Authors of publication	Amineh Aghabali; Marilyn M. Olmstead; Alan L. Balch
Journal of publication	Chem.Commun.
Year of publication	2014
Journal volume	50
Pages of publication	15152
a	19.3103 ± 0.0008 Å
b	19.7315 ± 0.0008 Å
c	19.9656 ± 0.0009 Å
α	90°
β	90°
γ	90°
Cell volume	7607.3 ± 0.6 Å³
Cell temperature	180 ± 2 K
Ambient diffraction temperature	180 ± 2 K
Number of distinct elements	6
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Residual factor for all reflections	0.1163
Residual factor for significantly intense reflections	0.0837
Weighted residual factors for significantly intense reflections	0.2316
Weighted residual factors for all reflections included in the refinement	0.2605
Goodness-of-fit parameter for all reflections included in the refinement	1.066
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
180274 (current)	2016-03-26	cif/7/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/11/60.	7116030.cif
128810	2014-12-17	cif/ Adding structures of 7116029, 7116030, 7116031, 7116032, 7116033 via cif-deposit CGI script.	7116030.cif