Crystallography Open Database

Information card for entry 4102380

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Coordinates	4102380.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H26 F3 N O4
Calculated formula	C24 H26 F3 N O4
Title of publication	Tandem Processes Identified from Reaction Screening: Nucleophilic Addition to Aryl N-Phosphinylimines Employing La(III)-TFAA Activation
Authors of publication	Hidenori Kinoshita; Oscar J. Ingham; Winnie W. Ong; Aaron B. Beeler; John A. Porco
Journal of publication	Journal of the American Chemical Society
Year of publication	2010
Journal volume	132
Pages of publication	6412 - 6418
a	11.6141 ± 0.0008 Å
b	18.8908 ± 0.0014 Å
c	10.0488 ± 0.0006 Å
α	90°
β	102.012 ± 0.002°
γ	90°
Cell volume	2156.4 ± 0.3 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
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	0.0733
Residual factor for significantly intense reflections	0.0484
Weighted residual factors for significantly intense reflections	0.1094
Weighted residual factors for all reflections included in the refinement	0.1215
Goodness-of-fit parameter for all reflections included in the refinement	1.04
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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