Crystallography Open Database

Information card for entry 4106060

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Coordinates	4106060.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H30 N2 O2 Pt
Calculated formula	C24 H30 N2 O2 Pt
SMILES	[Pt]123Oc4ccccc4C=[N]2CCCCCCCCCC[N]3=Cc2c(cccc2)O1
Title of publication	Highly Phosphorescent Crystals of Vaulted trans-Bis(salicylaldiminato)platinum(II) Complexes
Authors of publication	Naruyoshi Komiya; Minoru Okada; Kanako Fukumoto; Daisuke Jomori; Takeshi Naota
Journal of publication	Journal of the American Chemical Society
Year of publication	2011
Journal volume	133
Pages of publication	6493 - 6496
a	12.8077 ± 0.0006 Å
b	27.0706 ± 0.0013 Å
c	13.9033 ± 0.0007 Å
α	90°
β	113.592 ± 0.0011°
γ	90°
Cell volume	4417.5 ± 0.4 Å³
Cell temperature	113.1 K
Ambient diffraction temperature	113.1 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for significantly intense reflections	0.0791
Weighted residual factors for all reflections included in the refinement	0.1791
Goodness-of-fit parameter for all reflections included in the refinement	1.192
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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