Crystallography Open Database

Information card for entry 7039944

Preview

Coordinates	7039944.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H24 N4 O2 Pt2
Calculated formula	C30 H24 N4 O2 Pt2
SMILES	[Pt]12(c3ccccc3c3[n]1cccc3)Oc1c(N2C)cc2N([Pt]3(Oc2c1)[n]1c(c2c3cccc2)cccc1)C
Title of publication	Colour tuning by the stepwise synthesis of mononuclear and homo- and hetero-dinuclear platinum(ii) complexes using a zwitterionic quinonoid ligand.
Authors of publication	Kar, Paramita; Yoshida, Masaki; Kobayashi, Atsushi; Routaboul, Lucie; Braunstein, Pierre; Kato, Masako
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2016
Journal volume	45
Journal issue	36
Pages of publication	14080 - 14088
a	11.925 ± 0.003 Å
b	23.31 ± 0.005 Å
c	17.719 ± 0.004 Å
α	90°
β	95.191 ± 0.003°
γ	90°
Cell volume	4905 ± 2 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0608
Residual factor for significantly intense reflections	0.0484
Weighted residual factors for significantly intense reflections	0.1146
Weighted residual factors for all reflections included in the refinement	0.1254
Goodness-of-fit parameter for all reflections included in the refinement	1.028
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
187126 (current)	2016-10-08	cif/ Updating files of 7039943, 7039944, 7039945 Original log message: Adding full bibliography for 7039943--7039945.cif.	7039944.cif
184545	2016-07-20	cif/ Adding structures of 7039943, 7039944, 7039945 via cif-deposit CGI script.	7039944.cif