Crystallography Open Database

Information card for entry 7021784

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Structure parameters

Common name	3a
Formula	C39 H41 Cl5 N O P Pt
Calculated formula	C39 H41 Cl5 N O P Pt
Title of publication	Synthesis, structural characterization and cis-trans isomerization of novel (salicylaldiminato)platinum(ii) complexes.
Authors of publication	Zheng, Feng; Hutton, Alan T.; van Sittert, Cornelia G. C. E.; Moss, John R.; Mapolie, Selwyn F.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2013
Journal volume	42
Journal issue	31
Pages of publication	11163 - 11179
a	10.3272 ± 0.0009 Å
b	18.7983 ± 0.0017 Å
c	20.8684 ± 0.0018 Å
α	90°
β	100.185 ± 0.002°
γ	90°
Cell volume	3987.4 ± 0.6 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 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	0.0294
Residual factor for significantly intense reflections	0.0264
Weighted residual factors for significantly intense reflections	0.0654
Weighted residual factors for all reflections included in the refinement	0.0681
Goodness-of-fit parameter for all reflections included in the refinement	1.019
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
301848 (current)	2025-08-21	Add cross-references to PubChem compounds in COD range 7/02/ Each referenced PubChem compound corresponds to the full crystal structure.	7021784.cif
179922	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 7/02/17.	7021784.cif
87686	2013-08-27	cif/ Adding structures of 7021781, 7021782, 7021783, 7021784, 7021785 via cif-deposit CGI script.	7021784.cif