Crystallography Open Database

Information card for entry 7712472

Preview

Coordinates	7712472.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H35 Cl6 N2 O P Sn2
Calculated formula	C32 H35 Cl6 N2 O P Sn2
SMILES	[Sn]12(Cl)[O]=P(c3[n]1c(ccc3)C(=[N]2c1c(cccc1C(C)C)C(C)C)C)(c1ccccc1)c1ccccc1.[Sn](Cl)(Cl)[Cl-].ClCCl
Title of publication	Tin(ii) cations stabilized by non-symmetric N,N′,O-chelating ligands: synthesis and stability
Authors of publication	Novák, Miroslav; Turek, Jan; Milasheuskaya, Yaraslava; Syková, Miriam; Dostál, Libor; Stalmans, Jesse; R°užičková, Zdeňka; Jurkschat, Klaus; Jambor, Roman
Journal of publication	Dalton Transactions
Year of publication	2023
Journal volume	52
Journal issue	9
Pages of publication	2749 - 2761
a	12.0479 ± 0.0006 Å
b	12.0989 ± 0.0006 Å
c	13.7729 ± 0.0007 Å
α	87.484 ± 0.002°
β	68.313 ± 0.002°
γ	78.076 ± 0.002°
Cell volume	1824.1 ± 0.16 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0393
Residual factor for significantly intense reflections	0.0269
Weighted residual factors for significantly intense reflections	0.0563
Weighted residual factors for all reflections included in the refinement	0.0613
Goodness-of-fit parameter for all reflections included in the refinement	1.058
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
282621 (current)	2023-04-13	cod/ (saulius@tasmanijos-velnias) Fixing incorrectly parsed author names: codslave 'select file from data where authors like "%\|%"' -NB \| codid2file \| xargs -i sh -c 'DOI=$(awk "/^_journal_paper_doi/ {print \$2}" {}); MRK=$(basename $DOI).mrk; if ! [ -f $MRK ]; then ( set -x; crossref-get-biblio --doi $DOI > $MRK ) fi; head -v $MRK' codslave 'select file from data where authors like "%\|%"' -NB \| codid2file \| xargs -i sh -c 'DOI=$(awk "/^_journal_paper_doi/ {print \$2}" {}); MRK=$(basename $DOI).mrk; set -x; cif_filter --use-all-datablocks --biblio $MRK --fold-title --add-cif-header {} {} \| sponge {}' Commands and program versions: saulius@tasmanijos-velnias restore-biblio/ $ type codslave codslave is aliased to `mysql -u cod_reader -h sql.crystallography.net cod -e' saulius@tasmanijos-velnias restore-biblio/ $ type codid2file codid2file is /home/saulius/scripts/codid2file saulius@tasmanijos-velnias restore-biblio/ $ type cif_filter cif_filter is hashed (/usr/bin/cif_filter) saulius@tasmanijos-velnias restore-biblio/ $ cif_filter --version cod-tools version 2.10	7712472.cif
281200	2023-03-01	cif/ Adding structures of 7712470, 7712471, 7712472, 7712473, 7712474, 7712475, 7712476 via cif-deposit CGI script.	7712472.cif