Crystallography Open Database

Information card for entry 4070672

Preview

Coordinates	4070672.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H76 Cl F6 P3 Pd2
Calculated formula	C42 H76 Cl F6 P3 Pd2
Title of publication	Polymerization of Norbornene and Methyl Acrylate by a Bimetallic Palladium(II) Allyl Complex
Authors of publication	Szuromi, Endre; Shen, Han; Goodall, Brian L.; Jordan, Richard F.
Journal of publication	Organometallics
Year of publication	2008
Journal volume	27
Journal issue	3
Pages of publication	402
a	17.3322 ± 0.0017 Å
b	19.32 ± 0.002 Å
c	27.697 ± 0.004 Å
α	90°
β	90°
γ	90°
Cell volume	9274.6 ± 1.9 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0782
Residual factor for significantly intense reflections	0.0493
Weighted residual factors for significantly intense reflections	0.1114
Weighted residual factors for all reflections included in the refinement	0.1256
Goodness-of-fit parameter for all reflections included in the refinement	1.024
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
178595 (current)	2016-03-21	cif/4/07/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/07/06.	4070672.cif
120075	2014-07-11	Adding DOIs to range 4/07 structures.	4070672.cif
47256	2012-03-23	cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories.	4070672.cif
42634	2012-03-13	../uploads/cif-deposit/cod/cif Adding structures of 4070672 via cif-deposit CGI script.	4070672.cif