Crystallography Open Database

Information card for entry 4304105

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Coordinates	4304105.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H24 Cl F6 N6 O P Pt
Calculated formula	C24 H24 Cl F6 N6 O P Pt
SMILES	[Pt]12(Cl)[n]3c4ccccc4n(c3c3[n]1c(c1[n]2c2c(n1C)cccc2)ccc3)C.[P](F)(F)(F)(F)(F)[F-].O=CN(C)C
Title of publication	Structure of a Crystalline Vapochromic Platinum(II) Salt
Authors of publication	Levi J. Grove; Allen G. Oliver; Jeanette A. Krause; William B. Connick
Journal of publication	Inorganic Chemistry
Year of publication	2008
Journal volume	47
Pages of publication	1408 - 1410
a	26.983 ± 0.008 Å
b	8.53 ± 0.002 Å
c	25.018 ± 0.007 Å
α	90°
β	118.059 ± 0.007°
γ	90°
Cell volume	5081 ± 2 Å³
Cell temperature	183 ± 2 K
Ambient diffraction temperature	183 ± 2 K
Number of distinct elements	8
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0837
Residual factor for significantly intense reflections	0.0464
Weighted residual factors for significantly intense reflections	0.1078
Weighted residual factors for all reflections included in the refinement	0.1166
Goodness-of-fit parameter for all reflections included in the refinement	0.866
Diffraction radiation wavelength	0.775 Å
Diffraction radiation type	synchrotron
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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