Crystallography Open Database

Information card for entry 4112728

Preview

Coordinates	4112728.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H26 B2 F8
Calculated formula	C36 H26 B2 F8.128
Title of publication	Reaction of the 1,8-Bis(diphenylmethylium)naphthalenediyl Dication with Fluoride: Formation of a Cation Containing a C-F\ρightarrowC Bridge
Authors of publication	Huadong Wang; Charles Edwin Webster; Lisa M. Pérez; Michael B. Hall; François P. Gabbaï
Journal of publication	Journal of the American Chemical Society
Year of publication	2004
Journal volume	126
Pages of publication	8189 - 8196
a	17.6581 ± 0.0015 Å
b	10.4884 ± 0.0009 Å
c	16.0575 ± 0.0013 Å
α	90°
β	104.633 ± 0.002°
γ	90°
Cell volume	2877.5 ± 0.4 Å³
Cell temperature	110 ± 2 K
Ambient diffraction temperature	110 ± 2 K
Number of distinct elements	4
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	0.087
Residual factor for significantly intense reflections	0.0622
Weighted residual factors for significantly intense reflections	0.1456
Weighted residual factors for all reflections included in the refinement	0.1711
Goodness-of-fit parameter for all reflections included in the refinement	1.087
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4112728.html