Crystallography Open Database

Information card for entry 7021434

Preview

Coordinates	7021434.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H30 O8 Pd2
Calculated formula	C30 H30 O8 Pd2
SMILES	[Pd]12(OC(=C(C(=[O]2)C)C2=C(C)O[Pd]3(OC(=CC(=[O]3)c3ccccc3)C)[O]=C2C)C)OC(=CC(=[O]1)c1ccccc1)C
Title of publication	Axially chiral monomeric and dimeric square planar Pd(ii) complexes and their application to chiral tectonics.
Authors of publication	Sato, Hisako; Morimoto, Kazuya; Mori, Yukie; Shinagawa, Yuji; Kitazawa, Takafumi; Yamagishi, Akihiko
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2013
Journal volume	42
Journal issue	21
Pages of publication	7579 - 7585
a	11.32 ± 0.005 Å
b	33.405 ± 0.013 Å
c	15.802 ± 0.006 Å
α	90°
β	90°
γ	90°
Cell volume	5975 ± 4 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	4
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	0.1452
Residual factor for significantly intense reflections	0.0635
Weighted residual factors for significantly intense reflections	0.1579
Weighted residual factors for all reflections included in the refinement	0.1953
Goodness-of-fit parameter for all reflections included in the refinement	0.713
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
179919 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/14.	7021434.cif
86939	2013-07-12	cif/ Adding structures of 7021433, 7021434 via cif-deposit CGI script.	7021434.cif