Crystallography Open Database

Information card for entry 7032477

Preview

Coordinates	7032477.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H46 Cl8 N4 P2 Pd Sn2
Calculated formula	C40 H46 Cl8 N4 P2 Pd Sn2
SMILES	c1c([P]2([Pd]3([P](Nc4[n]3cccc4)(c3ccccc3)c3ccccc3)[n]3c(N2)cccc3)c2ccccc2)cccc1.[Sn](Cl)(Cl)(Cl)(C)C.[Sn](Cl)(Cl)(Cl)(C)C.ClCCCl
Title of publication	Pd(ii) coordinated deprotonated diphenyl phosphino amino pyridine: reactivity towards solvent, base, and acid.
Authors of publication	Pratihar, Sanjay; Pegu, Rupa; Guha, Ankur Kanti; Sarma, Bipul
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2014
Journal volume	43
Journal issue	45
Pages of publication	17136 - 17144
a	11.1221 ± 0.0002 Å
b	20.2361 ± 0.0004 Å
c	22.0997 ± 0.0004 Å
α	90°
β	106.545 ± 0.001°
γ	90°
Cell volume	4767.99 ± 0.16 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.051
Residual factor for significantly intense reflections	0.0366
Weighted residual factors for significantly intense reflections	0.0803
Weighted residual factors for all reflections included in the refinement	0.0864
Goodness-of-fit parameter for all reflections included in the refinement	1.021
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
180030 (current)	2016-03-25	cif/7/03/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/03/24.	7032477.cif
126414	2014-11-06	cif/ Updating files of 7032476, 7032477 Original log message: Adding full bibliography for 7032476--7032477.cif.	7032477.cif
123658	2014-09-10	cif/ Adding structures of 7032476, 7032477 via cif-deposit CGI script.	7032477.cif