Crystallography Open Database

Information card for entry 4115379

Preview

Coordinates	4115379.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H44
Calculated formula	C30 H44
Title of publication	A Remarkably Efficient Synthesis of Pure cis-Stilbenoid Hydrocarbons Using trans-Dibromoalkenes via Palladium Catalysis
Authors of publication	Rajendra Rathore; Mihaela I. Deselnicu; Carrie L. Burns
Journal of publication	Journal of the American Chemical Society
Year of publication	2002
Journal volume	124
Pages of publication	14832 - 14833
a	8.7774 ± 0.0009 Å
b	10.2972 ± 0.001 Å
c	13.6424 ± 0.0013 Å
α	92.513 ± 0.002°
β	90.93 ± 0.002°
γ	94.008 ± 0.002°
Cell volume	1228.6 ± 0.2 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	2
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0615
Residual factor for significantly intense reflections	0.0483
Weighted residual factors for significantly intense reflections	0.1307
Weighted residual factors for all reflections included in the refinement	0.1393
Goodness-of-fit parameter for all reflections included in the refinement	1.018
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
178924 (current)	2016-03-22	cif/4/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/11/53.	4115379.cif
120077	2014-07-12	Adding DOIs to range 4/11 structures.	4115379.cif
68846	2012-11-21	cif/ Adding structures of 4115379 via cif-deposit CGI script.	4115379.cif