Crystallography Open Database

Information card for entry 7003333

Preview

Coordinates	7003333.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C19 H13 Bi F18 N2 O3
Calculated formula	C19 H13 Bi F18 N2 O3
SMILES	[Bi](OC(C(F)(F)F)C(F)(F)F)(OC(C(F)(F)F)C(F)(F)F)([n]1ccccc1)(OC(C(F)(F)F)C(F)(F)F)[n]1ccccc1
Title of publication	Fluorinated bismuth alkoxides: from monomers to polymers and oxo-clusters
Authors of publication	Andrews, Philip C.; Junk, Peter C.; Nuzhnaya, Iryna; Spiccia, Leone
Journal of publication	Dalton Transactions
Year of publication	2008
Journal issue	19
Pages of publication	2557 - 2568
a	13.9674 ± 0.0003 Å
b	13.9674 ± 0.0003 Å
c	11.9283 ± 0.0003 Å
α	90°
β	90°
γ	120°
Cell volume	2015.3 ± 0.08 Å³
Cell temperature	123 ± 2 K
Ambient diffraction temperature	123 ± 2 K
Number of distinct elements	6
Space group number	145
Hermann-Mauguin space group symbol	P 32
Hall space group symbol	P 32
Residual factor for all reflections	0.0472
Residual factor for significantly intense reflections	0.0359
Weighted residual factors for significantly intense reflections	0.0522
Weighted residual factors for all reflections included in the refinement	0.0556
Goodness-of-fit parameter for all reflections included in the refinement	0.969
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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