Crystallography Open Database

Information card for entry 4323067

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Coordinates	4323067.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H32 Br2 F8 In2 O4
Calculated formula	C28 H32 Br2 F8 In2 O4
Title of publication	Perfluorinated Diindacycles
Authors of publication	Martin Tschinkl; Annette Schier; Jürgen Riede; François P. Gabbaï
Journal of publication	Inorganic Chemistry
Year of publication	1998
Journal volume	37
Pages of publication	5097 - 5101
a	9.636 ± 0.001 Å
b	11.129 ± 0.001 Å
c	16.029 ± 0.001 Å
α	90°
β	104.4 ± 0.01°
γ	90°
Cell volume	1664.9 ± 0.3 Å³
Cell temperature	203 ± 2 K
Ambient diffraction temperature	203 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0768
Residual factor for significantly intense reflections	0.0411
Weighted residual factors for all reflections	0.115
Weighted residual factors for significantly intense reflections	0.1001
Goodness-of-fit parameter for all reflections	1.073
Goodness-of-fit parameter for significantly intense reflections	1.149
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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