Crystallography Open Database

Information card for entry 1565222

Preview

Coordinates	1565222.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C13 H28 In N3 S2 Se
Calculated formula	C13 H28 In N3 S2 Se
SMILES	C(=N[In]12([N](CC(C)(S1)C)(C)C)[N](CC(C)(C)S2)(C)C)=[Se]
Title of publication	Indium complexes with aminothiolate ligands as single precursors for indium chalcogenides
Authors of publication	Park, Joo-Hyun; Chung, Taek-Mo; Park, Bo Keun; Kim, Chang Gyoun
Journal of publication	Inorganica Chimica Acta
Year of publication	2020
Journal volume	505
Pages of publication	119504
a	19.8009 ± 0.0005 Å
b	13.2812 ± 0.0003 Å
c	14.8388 ± 0.0004 Å
α	90°
β	90°
γ	90°
Cell volume	3902.3 ± 0.17 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	43
Hermann-Mauguin space group symbol	F d d 2
Hall space group symbol	F 2 -2d
Residual factor for all reflections	0.0139
Residual factor for significantly intense reflections	0.0132
Weighted residual factors for significantly intense reflections	0.0344
Weighted residual factors for all reflections included in the refinement	0.0348
Goodness-of-fit parameter for all reflections included in the refinement	0.763
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
270656 (current)	2021-11-15	cif/ Adding structures of 1565222, 1565223 via cif-deposit CGI script.	1565222.cif