Crystallography Open Database

Information card for entry 7206144

7206143 << 7206144 >> 7206145

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Coordinates	7206144.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H14 I9 N2
Calculated formula	C12 H14 I9 N2
Title of publication	Dimensional caging of polyiodides: cation-templated synthesis using bipyridinium salts
Authors of publication	García, Marcos D.; Martí-Rujas, Javier; Metrangolo, Pierangelo; Peinador, Carlos; Pilati, Tullio; Resnati, Giuseppe; Terraneo, Giancarlo; Ursini, Maurizio
Journal of publication	CrystEngComm
Year of publication	2011
Journal volume	13
Journal issue	13
Pages of publication	4411
a	7.3666 ± 0.0009 Å
b	7.5376 ± 0.0009 Å
c	26.01 ± 0.003 Å
α	89.788 ± 0.006°
β	86.141 ± 0.007°
γ	70.266 ± 0.006°
Cell volume	1356.1 ± 0.3 Å³
Cell temperature	295 ± 2 K
Ambient diffraction temperature	295 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0817
Residual factor for significantly intense reflections	0.0399
Weighted residual factors for significantly intense reflections	0.0951
Weighted residual factors for all reflections included in the refinement	0.1182
Goodness-of-fit parameter for all reflections included in the refinement	1.024
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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