Crystallography Open Database

Information card for entry 4088595

Preview

Coordinates	4088595.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C66 H104 Cl2 Li2 N6 O6 Si4 Y2
Calculated formula	C66 H104 Cl2 Li2 N6 O6 Si4 Y2
Title of publication	Reactivity of 3-Imino-Functionalized Indoles with Rare-Earth-Metal Amides: Unexpected Substituent Effects on C‒H Activation Pathways and Assembly of Rare-Earth-Metal Complexes
Authors of publication	Zhu, Xiancui; Li, Yang; Wei, Yun; Wang, Shaowu; Zhou, Shuangliu; Zhang, Lijun
Journal of publication	Organometallics
Year of publication	2016
Journal volume	35
Journal issue	11
Pages of publication	1838
a	17.8501 ± 0.0013 Å
b	18.1538 ± 0.0013 Å
c	24.2714 ± 0.0018 Å
α	90°
β	90°
γ	90°
Cell volume	7865.1 ± 1 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	8
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	0.1535
Residual factor for significantly intense reflections	0.0573
Weighted residual factors for significantly intense reflections	0.1069
Weighted residual factors for all reflections included in the refinement	0.1379
Goodness-of-fit parameter for all reflections included in the refinement	0.973
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
237694 (current)	2019-11-24	cif/ Adding structures of 4088593, 4088594, 4088595, 4088596, 4088597, 4088598, 4088599, 4088600, 4088601, 4088602, 4088603, 4088604 via cif-deposit CGI script.	4088595.cif