Crystallography Open Database

Information card for entry 4348899

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Coordinates	4348899.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H16 Cu2 I2 N4 S
Calculated formula	C16 H16 Cu2 I2 N4 S
Title of publication	Assembly of photoluminescent [CunIn] (n = 4, 6 and 8) clusters by clickable hybrid [N,S] ligands
Authors of publication	Bai, Shi-Qiang; Jiang, Lu; Tan, Ai Lin; Yeo, Sing Chen; Young, David James; Andy Hor, T. S.
Journal of publication	Inorganic Chemistry Frontiers
Year of publication	2015
Journal volume	2
Journal issue	11
Pages of publication	1011
a	9.1116 ± 0.0005 Å
b	9.1187 ± 0.0005 Å
c	13.5556 ± 0.0007 Å
α	76.481 ± 0.0017°
β	85.819 ± 0.0018°
γ	60.208 ± 0.0013°
Cell volume	949.09 ± 0.09 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0287
Residual factor for significantly intense reflections	0.0217
Weighted residual factors for significantly intense reflections	0.0398
Weighted residual factors for all reflections included in the refinement	0.0414
Goodness-of-fit parameter for all reflections included in the refinement	1.058
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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