Crystallography Open Database

Information card for entry 1503877

Preview

Coordinates	1503877.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H34 Cl2 O4 P2 Pt
Calculated formula	C24 H34 Cl2 O4 P2 Pt
SMILES	[Pt]1([P@@]2(c3ccccc3)CC[P@]1(CCOCCOCCOCCOCC2)c1ccccc1)(Cl)Cl
Title of publication	Practical synthesis of P-stereogenic diphosphacrowns.
Authors of publication	Morisaki, Yasuhiro; Imoto, Hiroaki; Tsurui, Kazuhiko; Chujo, Yoshiki
Journal of publication	Organic letters
Year of publication	2009
Journal volume	11
Journal issue	11
Pages of publication	2241 - 2244
a	9.0429 ± 0.0009 Å
b	14.936 ± 0.002 Å
c	19.4631 ± 0.0018 Å
α	90°
β	90°
γ	90°
Cell volume	2628.8 ± 0.5 Å³
Cell temperature	113 ± 2 K
Ambient diffraction temperature	113 ± 2 K
Number of distinct elements	6
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	0.0219
Residual factor for significantly intense reflections	0.0198
Weighted residual factors for significantly intense reflections	0.0581
Weighted residual factors for all reflections included in the refinement	0.06
Goodness-of-fit parameter for all reflections included in the refinement	0.509
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
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.	1503877.cif
91932	2013-12-28	cif/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the range 1 CIFs.	1503877.cif
39165	2012-03-07	../uploads/cif-deposit/cod/cif Adding structures of 1503877 via cif-deposit CGI script.	1503877.cif