Crystallography Open Database

Information card for entry 4063108

Preview

Coordinates	4063108.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C72 H92 Cl O6 P2 Rh
Calculated formula	C72 H92 Cl O6 P2 Rh
SMILES	C(#[O])[Rh]1([P]2(Oc3c(cc(cc3c3cc(cc(c3O2)C(C)(C)C)C(C)(C)C)C(C)(C)C)C(C)(C)C)c2c3c(ccc2)C(c2c(c(ccc2)[P]21Oc1c(cc(cc1c1cc(cc(c1O2)C(C)(C)C)C(C)(C)C)C(C)(C)C)C(C)(C)C)O3)(C)C)Cl
Title of publication	Rhodium Complexes of Sterically Demanding Diphosphonites: Coordination Chemistry and Catalysis
Authors of publication	J. I. van der Vlugt; R. Sablong; P. C. M. M. Magusin; A. M. Mills; A. L. Spek; D. Vogt
Journal of publication	Organometallics
Year of publication	2004
Journal volume	23
Pages of publication	3177
a	20.7367 ± 0.0002 Å
b	30.4055 ± 0.0003 Å
c	12.5622 ± 0.0001 Å
α	90°
β	90°
γ	90°
Cell volume	7920.59 ± 0.13 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
277847 (current)	2022-09-15	cif/ Added space group information derived from the space group operation list using the 'cif_filter' program.	4063108.cif
277846	2022-09-15	cif/ Reordered data items using the 'cif_filter' program to ensure that future changes to the file result in a minimal number of modified lines.	4063108.cif
100398	2014-02-05	4/06/31/ Fixing bibliography for structure 4063108.	4063108.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4063108.cif
966	2010-01-30	cif/ Adding _cod_database_code tags to all COD entries. Adding tag description to the cif_cod.dic dictionary so that COD entries can be validated.	4063108.cif
19	2008-01-26	Changing all end-of-line codes from DOS style to UNIX style in all COD CIF files, for more convenient processing: In the cod/cif/ directory: ff \*.cif \| xargs perl -i -pe 's/\r\n/\n/'	4063108.cif
14	2008-01-14	Appending a header with SVN keywords, COD URL and copying policy to all COD CIF files.	4063108.cif
13	2008-01-13	Setting the svn:keywords property to "Author Date Revision URL Id" for all CIF files in the cod/cif directory.	4063108.cif
1	2007-11-30	Adding all .cif files from the COD, downloaded in a Cod.zip file on 2007.02.07 (and the same Cod.zip is downloadable today, on 2007.11.29)	4063108.cif