Crystallography Open Database

Information card for entry 4312158

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Coordinates	4312158.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C119 H88 Ag3 F9 O11 S15
Calculated formula	C118.38 H62 Ag3 F7.14 O10 S15
Title of publication	Fluorescent Coordination Networks of 2,3,6,7,10,11-Hexakis(phenylthio)triphenylene and Silver(I) Triflate
Authors of publication	Kunhao Li; Zhengtao Xu; James C. Fettinger
Journal of publication	Inorganic Chemistry
Year of publication	2004
Journal volume	43
Pages of publication	8018 - 8022
a	12.073 ± 0.0005 Å
b	16.3911 ± 0.0007 Å
c	16.4728 ± 0.0007 Å
α	107.544 ± 0.001°
β	92.037 ± 0.001°
γ	104.555 ± 0.001°
Cell volume	2986.5 ± 0.2 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 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	0.0829
Residual factor for significantly intense reflections	0.0702
Weighted residual factors for significantly intense reflections	0.2288
Weighted residual factors for all reflections included in the refinement	0.2481
Goodness-of-fit parameter for all reflections included in the refinement	1.1
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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