Crystallography Open Database

Information card for entry 4083683

Preview

Coordinates	4083683.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C23 H31 N4 Yb
Calculated formula	C23 H31 N4 Yb
SMILES	[Yb]123456789%10(N(C(C)C)C(=[N]1c1ccccc1[NH2]2)NC(C)C)([cH]1[cH]3[cH]4[cH]5[cH]%101)[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	7.979 ± 0.003 Å
b	9.383 ± 0.004 Å
c	29.536 ± 0.012 Å
α	90°
β	90°
γ	90°
Cell volume	2211.3 ± 1.5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0336
Residual factor for significantly intense reflections	0.0316
Weighted residual factors for significantly intense reflections	0.0706
Weighted residual factors for all reflections included in the refinement	0.0712
Goodness-of-fit parameter for all reflections included in the refinement	1.093
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.	4083683.cif
117720	2014-06-15	cif/ Adding structures of 4083683 via cif-deposit CGI script.	4083683.cif