Crystallography Open Database

Information card for entry 4509195

Preview

Coordinates	4509195.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C108 H150 N12 O41 Tm2
Calculated formula	C107 H149 N14 O40 Tm2
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	14.131 ± 0.009 Å
b	14.823 ± 0.01 Å
c	17.441 ± 0.011 Å
α	67.778 ± 0.01°
β	70.407 ± 0.01°
γ	77.634 ± 0.01°
Cell volume	3170 ± 4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.1025
Residual factor for significantly intense reflections	0.0613
Weighted residual factors for significantly intense reflections	0.1439
Weighted residual factors for all reflections included in the refinement	0.1622
Goodness-of-fit parameter for all reflections included in the refinement	1.011
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
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.	4509195.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.	4509195.cif