Crystallography Open Database

Information card for entry 7000591

Preview

Coordinates	7000591.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C25 H35 Rh
Calculated formula	C25 H35 Rh
SMILES	[Rh]123456([c]78cccc[c]48[cH]3[cH]2[cH]17)([CH]1=[CH]5CCCCCC1)[CH]1=[CH]6CCCCCC1
Title of publication	Synthesis and structure of indenyl rhodium(I) complexes containing unsaturated phosphines: catalyst precursors for alkene hydroboration
Authors of publication	Garon, Christian N.; McIsaac, Daniel I.; Vogels, Christopher M.; Decken, Andreas; Williams, Ian D.; Kleeberg, Christian; Marder, Todd B.; Westcott, Stephen A.
Journal of publication	Dalton Transactions
Year of publication	2009
Journal issue	9
Pages of publication	1624 - 1631
a	7.3306 ± 0.0006 Å
b	13.462 ± 0.0012 Å
c	20.7134 ± 0.0019 Å
α	90°
β	90°
γ	90°
Cell volume	2044.1 ± 0.3 Å³
Cell temperature	173 ± 1 K
Ambient diffraction temperature	173 ± 1 K
Number of distinct elements	3
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0211
Residual factor for significantly intense reflections	0.0195
Weighted residual factors for significantly intense reflections	0.0488
Weighted residual factors for all reflections included in the refinement	0.0497
Goodness-of-fit parameter for all reflections included in the refinement	1.038
Diffraction radiation probe	x-ray
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
179683 (current)	2016-03-24	cif/7/00/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/00/05.	7000591.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7000591.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7000591.cif
1143	2010-05-03	cif/7/ Adding CIFs from Dalton-Trans-2009/ deposition.	7000591.cif