Crystallography Open Database

Information card for entry 1512359

Preview

Coordinates	1512359.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H34 Br3 O6
Calculated formula	C42 H33 Br3 O6
Title of publication	Organocatalyzed Asymmetric Synthesis of Dihydrodibenzofurans Based on a Dienamine Process.
Authors of publication	Wang, Zi-Yu; Wong, Wing-Tak; Yang, Dan
Journal of publication	Organic letters
Year of publication	2013
Journal volume	15
Journal issue	19
Pages of publication	4980 - 4983
a	15.8305 ± 0.001 Å
b	15.8305 ± 0.001 Å
c	4.1963 ± 0.0006 Å
α	90°
β	90°
γ	120°
Cell volume	910.72 ± 0.15 Å³
Cell temperature	305 ± 2 K
Ambient diffraction temperature	305 ± 2 K
Number of distinct elements	4
Space group number	145
Hermann-Mauguin space group symbol	P 32
Hall space group symbol	P 32
Residual factor for all reflections	0.0713
Residual factor for significantly intense reflections	0.065
Weighted residual factors for significantly intense reflections	0.1944
Weighted residual factors for all reflections included in the refinement	0.1977
Goodness-of-fit parameter for all reflections included in the refinement	1.093
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
176729 (current)	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1.	1512359.cif
89133	2013-10-09	cif/ Adding structures of 1512359 via cif-deposit CGI script.	1512359.cif