Crystallography Open Database

Information card for entry 7246718

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Coordinates	7246718.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C8 H8 I10 N4 Te
Calculated formula	C8 H10 I10 N4 Te
Title of publication	Bandgap modification in 0D tellurium iodide perovskite derivatives via incorporation of polyiodide species
Authors of publication	Walusiak, Benjamin W.; Raghavan, Adharsh; Cahill, Christopher L.
Journal of publication	RSC Advances
Year of publication	2023
Journal volume	13
Journal issue	20
Pages of publication	13477 - 13492
a	9.4074 ± 0.0003 Å
b	11.5528 ± 0.0004 Å
c	13.8021 ± 0.0004 Å
α	81.711 ± 0.001°
β	79.847 ± 0.001°
γ	69.01 ± 0.001°
Cell volume	1373.2 ± 0.08 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 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	0.0221
Residual factor for significantly intense reflections	0.02
Weighted residual factors for significantly intense reflections	0.0401
Weighted residual factors for all reflections included in the refinement	0.0405
Goodness-of-fit parameter for all reflections included in the refinement	1.327
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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