Crystallography Open Database

Information card for entry 4083679

Preview

Coordinates	4083679.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H41 N4 Yb
Calculated formula	C30 H41 N4 Yb
SMILES	[Yb]123456789%10(N(C%11CCCCC%11)C(NC%11CCCCC%11)=[N]1c1ccccc1C[NH2]2)([cH]1[cH]5[cH]%10[cH]4[cH]31)[cH]1[cH]6[cH]7[cH]8[cH]91
Title of publication	Multiple N−H Bond Activation: Synthesis and Reactivity of Functionalized Primary Amido Ytterbium Complexes
Authors of publication	Pi, Chengfu; Zhang, Zhengxing; Pang, Zhen; Zhang, Jie; Luo, Jun; Chen, Zhenxia; Weng, Linhong; Zhou, Xigeng
Journal of publication	Organometallics
Year of publication	2007
Journal volume	26
Journal issue	8
Pages of publication	1934
a	16.007 ± 0.005 Å
b	32.816 ± 0.009 Å
c	10.753 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	5648 ± 3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	56
Hermann-Mauguin space group symbol	P c c n
Hall space group symbol	-P 2ab 2ac
Residual factor for all reflections	0.0495
Residual factor for significantly intense reflections	0.0311
Weighted residual factors for significantly intense reflections	0.071
Weighted residual factors for all reflections included in the refinement	0.0768
Goodness-of-fit parameter for all reflections included in the refinement	1.098
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
178725 (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 4/08/36.	4083679.cif
117716	2014-06-15	cif/ Adding structures of 4083679 via cif-deposit CGI script.	4083679.cif