Crystallography Open Database

Information card for entry 4111019

Preview

Coordinates	4111019.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C34 H43 O4 Os P Pt Sn
Calculated formula	C34 H43 O4 Os P Pt Sn
SMILES	[Pt]12([Os]([Sn](c3ccccc3)(c3ccccc3)c3ccccc3)(C1=O)(C#[O])(C#[O])(C#[O])[H]2)[P](C(C)(C)C)(C(C)(C)C)C(C)(C)C
Title of publication	Platinum Promoted Insertion of an Alkyne into a Metal-Hydrogen Bond
Authors of publication	Richard D. Adams; Burjor Captain; Lei Zhu
Journal of publication	Journal of the American Chemical Society
Year of publication	2006
Journal volume	128
Pages of publication	13672 - 13673
a	15.3785 ± 0.0008 Å
b	12.0732 ± 0.0006 Å
c	20.6568 ± 0.001 Å
α	90°
β	108.841 ± 0.001°
γ	90°
Cell volume	3629.8 ± 0.3 Å³
Cell temperature	294 ± 2 K
Ambient diffraction temperature	294 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0539
Residual factor for significantly intense reflections	0.0376
Weighted residual factors for significantly intense reflections	0.0961
Weighted residual factors for all reflections included in the refinement	0.1087
Goodness-of-fit parameter for all reflections included in the refinement	1.031
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
178881 (current)	2016-03-22	cif/4/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/11/10.	4111019.cif
120077	2014-07-12	Adding DOIs to range 4/11 structures.	4111019.cif
60542	2012-06-15	cif/ Adding structures of 4111019 via cif-deposit CGI script.	4111019.cif