Crystallography Open Database

Information card for entry 1551529

Preview

Coordinates	1551529.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	bis(2-methoxy-6-((Z)-(p-tolyimino)- methyl)phenoxy)palladium
Chemical name	bis(2-methoxy-6-((Z)-(p-tolyimino)- methyl)phenoxy)palladium
Formula	C30 H28 N2 O4 Pd
Calculated formula	C30 H26 N2 O4 Pd
SMILES	COc1cccc2c1O[Pd]1([N](c3ccc(cc3)C)=Cc3cccc(c3O1)OC)[N](=C2)c1ccc(cc1)C
Title of publication	Crystal Structure of Bis(2-methoxy-6-((<i>Z</i>)-(<i>p</i>-tolylimino)methyl)phenoxy)palladium
Authors of publication	KASSIM, Karimah; KAHAR, Muhammad Ashraf Mohd; YAMIN, Bohari M.; MANAN, Mohd Abdul Fatah Abdul; YUSOF, M. Sukeri M.
Journal of publication	X-ray Structure Analysis Online
Year of publication	2019
Journal volume	35
Journal issue	0
Pages of publication	25
a	13.0221 ± 0.0014 Å
b	11.6615 ± 0.0013 Å
c	8.4898 ± 0.0009 Å
α	90°
β	97.327 ± 0.004°
γ	90°
Cell volume	1278.7 ± 0.2 Å³
Cell temperature	273 ± 2 K
Ambient diffraction temperature	273 ± 2 K
Number of distinct elements	5
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	0.0472
Residual factor for significantly intense reflections	0.0349
Weighted residual factors for significantly intense reflections	0.0742
Weighted residual factors for all reflections included in the refinement	0.0824
Goodness-of-fit parameter for all reflections included in the refinement	1.185
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
216139 (current)	2019-06-20	cif/ Adding structures of 1551529 via cif-deposit CGI script.	1551529.cif