Crystallography Open Database

Information card for entry 7215821

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Coordinates	7215821.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H32 F4 N8
Calculated formula	C32 H32 F4 N8
Title of publication	Structural and optical investigations of charge transfer complexes involving the F4TCNQ dianion
Authors of publication	Sutton, Ashley L.; Abrahams, Brendan F.; D'Alessandro, Deanna M.; Elliott, Robert W.; Hudson, Timothy A.; Robson, Richard; Usov, Pavel M.
Journal of publication	CrystEngComm
Year of publication	2014
a	13.4546 ± 0.0011 Å
b	11.4276 ± 0.001 Å
c	9.1962 ± 0.0009 Å
α	90°
β	101.49 ± 0.008°
γ	90°
Cell volume	1385.6 ± 0.2 Å³
Cell temperature	130 ± 0.1 K
Ambient diffraction temperature	130 ± 0.1 K
Number of distinct elements	4
Space group number	12
Hermann-Mauguin space group symbol	C 1 2/m 1
Hall space group symbol	-C 2y
Residual factor for all reflections	0.0622
Residual factor for significantly intense reflections	0.0523
Weighted residual factors for significantly intense reflections	0.1459
Weighted residual factors for all reflections included in the refinement	0.1557
Goodness-of-fit parameter for all reflections included in the refinement	1.073
Diffraction radiation wavelength	1.5418 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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