Crystallography Open Database

Information card for entry 8000041

Preview

Coordinates	8000041.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C39 H17 Cl3 F14 N2 Pt
Calculated formula	C39 H17 Cl3 F14 N2 Pt
SMILES	[Pt]1([n]2ccc(c3ccc4c([n]1ccc4c1ccccc1)c23)c1ccccc1)(c1c(F)c(F)c(c(F)c1F)C(F)(F)F)c1c(F)c(F)c(c(F)c1F)C(F)(F)F.ClC(Cl)Cl
Title of publication	Preparation, Characterization, and Electroluminescence Characteristics of α-Diimine-type Platinum(II) Complexes with Perfluorinated Phenyl Groups as Ligands
Authors of publication	Jun-ichi Nishida; Akihiro Maruyama; Takeshi Iwata; Yoshiro Yamashita
Journal of publication	Chemistry Letters
Year of publication	2005
Journal volume	34
Journal issue	4
Pages of publication	592
a	11.237 ± 0.004 Å
b	11.509 ± 0.005 Å
c	16.302 ± 0.005 Å
α	106.23 ± 0.03°
β	107.87 ± 0.03°
γ	91.41 ± 0.03°
Cell volume	1912 ± 1 Å³
Cell temperature	296.2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for significantly intense reflections	0.0538
Weighted residual factors for all reflections included in the refinement	0.1585
Goodness-of-fit parameter for all reflections included in the refinement	1.272
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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