Crystallography Open Database

Information card for entry 4079827

Preview

Coordinates	4079827.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C116 H122 O35.5 P4 Rh2
Calculated formula	C116 H122 O35.5 P4 Rh2
Title of publication	Synthesis, Structural Analysis, and Catalytic Properties of Tetrakis(binaphthyl or octahydrobinaphthyl phosphate) Dirhodium(II,II) Complexes
Authors of publication	Hrdina, Radim; Guénée, Laure; Moraleda, Delphine; Lacour, Jérôme
Journal of publication	Organometallics
Year of publication	2013
Journal volume	32
Journal issue	2
Pages of publication	473
a	14.72965 ± 0.00019 Å
b	20.6819 ± 0.0002 Å
c	18.2822 ± 0.0002 Å
α	90°
β	101.101 ± 0.0012°
γ	90°
Cell volume	5465.22 ± 0.11 Å³
Cell temperature	180 ± 2 K
Ambient diffraction temperature	180 ± 2 K
Number of distinct elements	5
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0441
Residual factor for significantly intense reflections	0.043
Weighted residual factors for significantly intense reflections	0.1157
Weighted residual factors for all reflections included in the refinement	0.1182
Goodness-of-fit parameter for all reflections included in the refinement	1.028
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176432 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	4079827.cif
107967	2014-03-25	cif/4 Changing the entity to the proper non-English character for many entries in subdir 4	4079827.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4079827.cif
74077	2013-02-21	cif/ Adding structures of 4079827, 4079828, 4079829 via cif-deposit CGI script.	4079827.cif