Crystallography Open Database

Information card for entry 4300446

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Coordinates	4300446.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H70 Fe O2 S2 Si2
Calculated formula	C32 H70 Fe O2 S2 Si2
SMILES	[Fe](S[Si](C(C)(C)C)(C(C)(C)C)C(C)(C)C)(S[Si](C(C)(C)C)(C(C)(C)C)C(C)(C)C)([O]1CCCC1)[O]1CCCC1
Journal of publication	Inorganic Chemistry
Year of publication	2006
a	12.897 ± 0.002 Å
b	13.217 ± 0.001 Å
c	13.22 ± 0.001 Å
α	98.1 ± 0.01°
β	104.32 ± 0.01°
γ	109.86 ± 0.01°
Cell volume	1990.1 ± 0.4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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 significantly intense reflections	0.0494
Weighted residual factors for significantly intense reflections	0.1311
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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