Crystallography Open Database

Information card for entry 7027183

Preview

Coordinates	7027183.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14 H18 I2 N2 Pt
Calculated formula	C14 H18 I2 N2 Pt
SMILES	[Pt](I)(I)([n]1c(cccc1)CC)[n]1c(cccc1)CC
Title of publication	Chirality in mononuclear square planar complexes
Authors of publication	Biagini, Marina Cingi; Ferrari, Maura; Lanfranchi, Maurizio; Marchiò, Luciano; Pellinghelli, Maria Angela
Journal of publication	Journal of the Chemical Society, Dalton Transactions
Year of publication	1999
Journal issue	10
Pages of publication	1575
a	10.693 ± 0.006 Å
b	13.656 ± 0.007 Å
c	11.749 ± 0.006 Å
α	90°
β	93.41 ± 0.02°
γ	90°
Cell volume	1712.6 ± 1.6 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/a 1
Hall space group symbol	-P 2yab
Residual factor for all reflections	0.0725
Residual factor for significantly intense reflections	0.0455
Weighted residual factors for significantly intense reflections	0.1233
Weighted residual factors for all reflections included in the refinement	0.1315
Goodness-of-fit parameter for all reflections included in the refinement	0.983
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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