Accelerated Arene Ligand Exchange in the (Arene)Cr(CO)2L Series
M. F. Semmelhack; Anatoly Chlenov; Douglas M. Ho; Journal of the American Chemical Society 127 (2005) 7759–7773; doi:10.1021/ja042705x

data_4111715
_publ_contact_author_address
;
Princeton University
Department of Chemistry
Princeton, NJ   08544-1009
USA
;
_publ_contact_author_email       mfshack@princeton.edu
_publ_contact_author_fax         (609)2586746
_publ_contact_author_name        'Professor Martin F. Semmelhack'
_publ_contact_author_phone       (609)2585501
_publ_section_title
;
 Accelerated Arene Ligand Exchange in the (Arene)Cr(CO)2L Series
;
_journal_name_full               'Journal of the American Chemical Society'
_journal_page_first              7759
_journal_page_last               7773
_journal_paper_doi               10.1021/ja042705x
_journal_volume                  127
_journal_year                    2005
_chemical_compound_source        'chemical synthesis'
_chemical_formula_iupac          '[Cr (C O)2 (C6 H6) (C13 H14 N3 P S)]'
_chemical_formula_moiety         'C21 H20 Cr N3 O2 P S'
_chemical_formula_structural
'((C O)2 (C6 H6) (P (C4 H4 N)2 (C5 H6 N S)) Cr)'
_chemical_formula_sum            'C21 H20 Cr N3 O2 P S'
_chemical_formula_weight         461.43
_chemical_name_systematic
; 
Benzenedicarbonyl[P-bis(N-pyrrolyl)(2-thiomethyl-N-pyrrolyl)phosphine]-
chromium(0)
;
_chemical_temperature_decomposition 420(1)
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_audit_creation_date             'October 28, 2004'
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;
SHELXL and manual editing of form.cif
;
_audit_update_record
;
Oct. 28, 2004  mfs44a.cif         Initial CIF created by DMH
                                  from mfs008f.cif and mfs008f.exp.

Oct. 28, 2004  Sent to Checkcif.  See mfs44a_checkcif.pdf for
                                  the alerts that were generated.

Before submission of either a Web or hardcopy manuscript, CIFs must be
checked using the CheckCIF utility on the Web at http://www.iucr.org/
acs/checkcif.html.  A copy of the output should be retained in case
it is requested by an Editor.  Authors with appropriate software may
alternatively use IUCRVAL or the CHECK validation tool in PLATON.
;
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'w=1/[\s^2^(Fo^2^)+(0.0411P)^2^+1.4462P] where P=(Fo^2^+2Fc^2^)/3'
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