Crystallography Open Database

Information card for entry 7202607

7202606 << 7202607 >> 7202608

Preview

Coordinates	7202607.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C35 H35 Cl2 N O4 P2 Pd S
Calculated formula	C35 H35 Cl2 N O4 P2 Pd S
Title of publication	Hydrogen bonded supramolecular assemblies based on neutral square-planar palladium(ii) complexes
Authors of publication	Smith, Martin B.; Dale, Sophie H.; Coles, Simon J.; Gelbrich, Thomas; Hursthouse, Michael B.; Light, Mark E.; Horton, Peter N.
Journal of publication	CrystEngComm
Year of publication	2007
Journal volume	9
Journal issue	2
Pages of publication	165
a	19.631 ± 0.004 Å
b	17.047 ± 0.003 Å
c	10.506 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	3515.8 ± 1.2 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	8
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Residual factor for all reflections	0.1096
Residual factor for significantly intense reflections	0.0784
Weighted residual factors for significantly intense reflections	0.2041
Weighted residual factors for all reflections included in the refinement	0.2292
Goodness-of-fit parameter for all reflections included in the refinement	1.028
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
180357 (current)	2016-03-26	cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/26.	7202607.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7202607.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7202607.cif
1188	2010-06-06	cif/{1,7}/ Adding CIFs from Miguel-Quiros-2010_05, New-J-Chem-2007, Org-Biomol-Chem-2007 and RSC-2007 data extraction directories.	7202607.cif