Crystallography Open Database

Information card for entry 4509197

Preview

Coordinates	4509197.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C80 H92 Lu N13 O23
Calculated formula	C80 H91 Lu N13 O23
Title of publication	Design and Synthesis of Two New Two-Photon Absorbing Pyridine Salts as Ligands and Their Rare Earth Complexes
Authors of publication	Tian, Yu-Peng; Li, Lin; Zhou, Yong-Hong; Wang, Peng; Zhou, Hong-Ping; Wu, Jie-Ying; Hu, Zhang-Jun; Yang, Jia-Xiang; Kong, Lin; Xu, Gui-Bao; Tao, Xu-Tang; Jiang, Min-Hua
Journal of publication	Crystal Growth & Design
Year of publication	2009
Journal volume	9
Journal issue	3
Pages of publication	1499
a	14.752 ± 0.002 Å
b	17.554 ± 0.003 Å
c	17.876 ± 0.002 Å
α	106.567 ± 0.003°
β	100.08 ± 0.002°
γ	102.121 ± 0.003°
Cell volume	4199.5 ± 1 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0944
Residual factor for significantly intense reflections	0.0606
Weighted residual factors for significantly intense reflections	0.1619
Weighted residual factors for all reflections included in the refinement	0.1733
Goodness-of-fit parameter for all reflections included in the refinement	1.004
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
179627 (current)	2016-03-24	cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/91.	4509197.cif
97162	2014-01-29	cif/ Adding structures of 4509188, 4509189, 4509190, 4509191, 4509192, 4509193, 4509194, 4509195, 4509196, 4509197, 4509198, 4509199, 4509200, 4509201, 4509202, 4509203 via cif-deposit CGI script.	4509197.cif