Crystallography Open Database

Information card for entry 7203429

7203428 << 7203429 >> 7203430

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Coordinates	7203429.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H8 Br4 Fe I4 S4 Se8
Calculated formula	C16 H8 Br4 Fe I4 S4 Se8
Title of publication	New organic conductors based on dibromo- and diiodo-TSeFs with magnetic and non-magnetic MX4 counter anions (M = Fe, Ga; X = Cl, Br)
Authors of publication	Shirahata, Takashi; Kibune, Megumi; Maesato, Mitsuhiko; Kawashima, Tomohito; Saito, Gunzi; Imakubo, Tatsuro
Journal of publication	Journal of Materials Chemistry
Year of publication	2006
Journal volume	16
Journal issue	33
Pages of publication	3381
a	7.317 ± 0.002 Å
b	36.582 ± 0.012 Å
c	13.569 ± 0.004 Å
α	90°
β	90°
γ	90°
Cell volume	3632 ± 1.9 Å³
Cell temperature	293 K
Ambient diffraction temperature	293 K
Number of distinct elements	7
Space group number	72
Hermann-Mauguin space group symbol	I b a m
Hall space group symbol	-I 2 2c
Residual factor for all reflections	0.0913
Residual factor for significantly intense reflections	0.0534
Weighted residual factors for significantly intense reflections	0.126
Weighted residual factors for all reflections included in the refinement	0.1552
Goodness-of-fit parameter for all reflections included in the refinement	1.007
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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