Crystallography Open Database

Information card for entry 1505810

Preview

Coordinates	1505810.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C31 H26 O2 P2
Calculated formula	C31 H26 O2 P2
Title of publication	Rhodium-Catalyzed Asymmetric Conjugate Additions of Boronic Acids to enones using DIPHONANE: a novel chiral bisphosphine ligand.
Authors of publication	Vandyck, Koen; Matthys, Bavo; Willen, Mario; Robeyns, Koen; Van Meervelt, Luc; Van der Eycken, Johan
Journal of publication	Organic letters
Year of publication	2006
Journal volume	8
Journal issue	3
Pages of publication	363 - 366
a	32.3106 ± 0.0008 Å
b	12.0276 ± 0.0003 Å
c	12.5523 ± 0.0003 Å
α	90°
β	90°
γ	90°
Cell volume	4878.1 ± 0.2 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	4
Space group number	43
Hermann-Mauguin space group symbol	F d d 2
Hall space group symbol	F 2 -2d
Residual factor for all reflections	0.0305
Residual factor for significantly intense reflections	0.0296
Weighted residual factors for significantly intense reflections	0.0722
Weighted residual factors for all reflections included in the refinement	0.0727
Goodness-of-fit parameter for all reflections included in the refinement	1.13
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
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.	1505810.cif
120071	2014-07-11	Adding DOIs to range 1 structures.	1505810.cif
47757	2012-03-26	../uploads/cif-deposit/cod/cif Adding structures of 1505810, 1505811 via cif-deposit CGI script.	1505810.cif