Crystallography Open Database

Information card for entry 4000331

Preview

Coordinates	4000331.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	01293y
Formula	C9 H18 F3 Li O7 S
Calculated formula	C9 H18 F3 Li O7 S
Journal of publication	Chemistry of Materials
Year of publication	2003
a	13.017 ± 0.002 Å
b	6.3311 ± 0.0009 Å
c	18.692 ± 0.003 Å
α	90°
β	97.281 ± 0.002°
γ	90°
Cell volume	1528 ± 0.4 Å³
Cell temperature	173 ± 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	0.068
Residual factor for significantly intense reflections	0.0549
Weighted residual factors for significantly intense reflections	0.1412
Weighted residual factors for all reflections included in the refinement	0.1464
Goodness-of-fit parameter for all reflections included in the refinement	1.113
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

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