Crystallography Open Database

Information card for entry 7154172

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Coordinates	7154172.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H28 B Cl2 F10 P
Calculated formula	C36 H28 B Cl2 F10 P
Title of publication	1,1-Alkenylboration of diarylphosphino-enynes: convenient synthetic entry to vicinal P/B Lewis pairs at extended conjugated π-frameworks.
Authors of publication	Chen, Guo-Qiang; Kehr, Gerald; Daniliuc, Constantin G.; Erker, Gerhard
Journal of publication	Organic & biomolecular chemistry
Year of publication	2015
Journal volume	13
Journal issue	3
Pages of publication	764 - 769
a	20.771 ± 0.0009 Å
b	10.2846 ± 0.0005 Å
c	18.6572 ± 0.0009 Å
α	90°
β	120.235 ± 0.004°
γ	90°
Cell volume	3443.4 ± 0.3 Å³
Cell temperature	223 ± 2 K
Ambient diffraction temperature	223 ± 2 K
Number of distinct elements	6
Space group number	9
Hermann-Mauguin space group symbol	C 1 c 1
Hall space group symbol	C -2yc
Residual factor for all reflections	0.0678
Residual factor for significantly intense reflections	0.0546
Weighted residual factors for significantly intense reflections	0.1256
Weighted residual factors for all reflections included in the refinement	0.1374
Goodness-of-fit parameter for all reflections included in the refinement	1.052
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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