Crystallography Open Database

Information card for entry 4038985

Preview

Coordinates	4038985.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	[(RTeI3)(I3)](PyH)
Chemical name	(pyridonium) 2,3,5,6-tetramethylphenyltellurium tri-iodine . tri-iodide
Formula	C15 H19 I6 N Te
Calculated formula	C15 H19 I6 N Te
SMILES	[I]([I][I][Te](I)(I)c1c(C)c(C)cc(c1C)C)I.c1cccc[nH+]1
Title of publication	Synthesis and structural features of new aryltellurenyl iodides
Authors of publication	Faoro, Eliandro; de Oliveira, Gelson Manzoni; Lang, Ernesto Schulz; Pereira, Cesar Bicca
Journal of publication	Journal of Organometallic Chemistry
Year of publication	2010
Journal volume	695
Journal issue	10-11
Pages of publication	1480 - 1486
a	12.082 ± 0.003 Å
b	8.861 ± 0.002 Å
c	24.18 ± 0.005 Å
α	90°
β	102.702 ± 0.003°
γ	90°
Cell volume	2525.3 ± 1 Å³
Cell temperature	170 ± 2 K
Ambient diffraction temperature	170 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.1489
Residual factor for significantly intense reflections	0.0601
Weighted residual factors for significantly intense reflections	0.1445
Weighted residual factors for all reflections included in the refinement	0.1924
Goodness-of-fit parameter for all reflections included in the refinement	1.016
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
272288 (current)	2022-01-27	cif/ Adding structures of 4038982, 4038983, 4038984, 4038985, 4038986, 4038987, 4038988 via cif-deposit CGI script.	4038985.cif