Crystallography Open Database

Information card for entry 4083684

Preview

Coordinates	4083684.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H32 N4 Yb
Calculated formula	C24 H32 N4 Yb
SMILES	[Yb]123456789%10([N](C(C)C)=C(NC(C)C)N1c1ccccc1CN2)([cH]1[cH]3[cH]4[cH]5[cH]61)[cH]1[cH]9[cH]8[cH]7[cH]%101
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	8.357 ± 0.002 Å
b	9.922 ± 0.003 Å
c	28.681 ± 0.008 Å
α	90°
β	90°
γ	90°
Cell volume	2378.2 ± 1.1 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	0.0289
Residual factor for significantly intense reflections	0.0252
Weighted residual factors for significantly intense reflections	0.0424
Weighted residual factors for all reflections included in the refinement	0.0431
Goodness-of-fit parameter for all reflections included in the refinement	0.96
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
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4083684.cif
174394	2016-01-12	cif/4 Fixing some Z values and formulae	4083684.cif
117721	2014-06-15	cif/ Adding structures of 4083684 via cif-deposit CGI script.	4083684.cif