Crystallography Open Database

Information card for entry 4350688

Preview

Coordinates	4350688.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	(OC-6-34)-Chlorido(cyclobutane-1,1'-dicarboxylate) (cyclohexane-1R,2R,diamine)(ethane-1,2-diol)platinum(IV)
Formula	C14 H31 Cl N2 O9 Pt
Calculated formula	C14 H24 Cl N2 O9 Pt
SMILES	[Pt]12(Cl)(OC(=O)C3(C(=O)O1)CCC3)(OCCO)[NH2][C@@H]1CCCC[C@H]1[NH2]2.O.O.O
Title of publication	A new entry to asymmetric platinum(IV) complexes via oxidative chlorination.
Authors of publication	Ravera, Mauro; Gabano, Elisabetta; Pelosi, Giorgio; Fregonese, Federico; Tinello, Stefano; Osella, Domenico
Journal of publication	Inorganic chemistry
Year of publication	2014
Journal volume	53
Journal issue	17
Pages of publication	9326 - 9335
a	9.781 ± 0.002 Å
b	21.416 ± 0.003 Å
c	11.228 ± 0.002 Å
α	90°
β	115.298 ± 0.003°
γ	90°
Cell volume	2126.4 ± 0.7 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0736
Residual factor for significantly intense reflections	0.0507
Weighted residual factors for significantly intense reflections	0.1086
Weighted residual factors for all reflections included in the refinement	0.1182
Goodness-of-fit parameter for all reflections included in the refinement	0.98
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
254024 (current)	2020-07-06	cif/4 Fixing Z values and formulae	4350688.cif
239986	2019-11-25	cif/ Adding structures of 4350688 via cif-deposit CGI script.	4350688.cif