Crystallography Open Database

Information card for entry 7721051

Preview

Coordinates	7721051.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C315 H244 Au8 Cl2 Cu8 F32 N8 O8 P16
Calculated formula	C315 H244 Au8 Cl2 Cu8 F32 N8 O8 P16
Title of publication	Triphenylene Chromophore Enhances Emission in Au/Cu Heterometallic Complexes
Authors of publication	Ahmad, Jalal; Atencio, Anyie P.; Ward, Jas S.; Engeser, Marianne; Rissanen, Kari; Angurell, Inmaculada; Rodriguez, Laura
Journal of publication	Dalton Transactions
Year of publication	2026
a	18.8859 ± 0.0004 Å
b	19.3043 ± 0.0003 Å
c	22.4193 ± 0.0004 Å
α	89.931 ± 0.001°
β	69.06 ± 0.002°
γ	66.344 ± 0.002°
Cell volume	6895.1 ± 0.3 Å³
Cell temperature	120.01 ± 0.1 K
Ambient diffraction temperature	120.01 ± 0.1 K
Number of distinct elements	9
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0468
Residual factor for significantly intense reflections	0.0391
Weighted residual factors for significantly intense reflections	0.0926
Weighted residual factors for all reflections included in the refinement	0.096
Goodness-of-fit parameter for all reflections included in the refinement	1.04
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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