Crystallography Open Database

Information card for entry 1564055

Preview

Coordinates	1564055.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H34 B F4 N4 P Pt
Calculated formula	C42 H34 B F4 N4 P Pt
SMILES	[Pt]12(c3c(c4[n]2cccc4)cccc3)[P](c2cccc3ccc([n]1c23)c1ccccc1)(c1ccccc1)c1ccccc1.[B](F)(F)(F)[F-].N#CC.N#CC
Title of publication	Mixed-ligand platinum(II) complexes containing 2-(2′-pyridyl)phenyl and 8-quinolylphosphines: Synthesis and molecular structures in the crystals and in solution
Authors of publication	Mori, Masatoshi; Suzuki, Takayoshi
Journal of publication	Inorganica Chimica Acta
Year of publication	2020
Journal volume	512
Pages of publication	119862
a	18.754 ± 0.001 Å
b	8.0883 ± 0.0005 Å
c	24.8439 ± 0.0015 Å
α	90°
β	99.739 ± 0.002°
γ	90°
Cell volume	3714.2 ± 0.4 Å³
Cell temperature	188 ± 2 K
Ambient diffraction temperature	188 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0334
Residual factor for significantly intense reflections	0.0254
Weighted residual factors for significantly intense reflections	0.0538
Weighted residual factors for all reflections included in the refinement	0.0568
Goodness-of-fit parameter for all reflections included in the refinement	1.028
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
267390 (current)	2021-07-08	cif/ Adding structures of 1564055 via cif-deposit CGI script.	1564055.cif