Crystallography Open Database

Information card for entry 4080935

Preview

Coordinates	4080935.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C50 H70 N7 O3 Yb
Calculated formula	C50 H70 N7 O3 Yb
Title of publication	Synthesis of a Naphthalene-Bridged Bis(guanidinato)ytterbium(II) Complex and an Unexpected Pathway in Its Reaction with CH3CN,p-ClC6H4CH2CN, and Ph2CHCN
Authors of publication	Wang, Chuanyong; Zhang, Xingmin; Xue, Mingqiang; Zhang, Yong; Shen, Qi
Journal of publication	Organometallics
Year of publication	2013
Journal volume	32
Journal issue	13
Pages of publication	3618
a	13.1512 ± 0.0003 Å
b	15.0219 ± 0.0004 Å
c	24.6389 ± 0.0007 Å
α	90°
β	97.087 ± 0.003°
γ	90°
Cell volume	4830.4 ± 0.2 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0623
Residual factor for significantly intense reflections	0.0449
Weighted residual factors for significantly intense reflections	0.1153
Weighted residual factors for all reflections included in the refinement	0.1209
Goodness-of-fit parameter for all reflections included in the refinement	1.09
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
178698 (current)	2016-03-21	cif/4/08/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/08/09.	4080935.cif
87954	2013-08-27	cif/ Adding structures of 4080932, 4080933, 4080934, 4080935 via cif-deposit CGI script.	4080935.cif