Crystallography Open Database

Information card for entry 4109138

Preview

Coordinates	4109138.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H46 N2 O2 Pt
Calculated formula	C32 H46 N2 O2 Pt
SMILES	c12c(cc(cc1C=[N]1[Pt]3(O2)[N](=Cc2c(c(cc(c2)C(C)(C)C)C(C)(C)C)O3)CC1)C(C)(C)C)C(C)(C)C
Title of publication	Syntheses and Electronic Structures of One-Electron-Oxidized Group 10 Metal(II)-(Disalicylidene)diamine Complexes (Metal = Ni, Pd, Pt)
Authors of publication	Yuichi Shimazaki; Tatsuo Yajima; Fumito Tani; Satoru Karasawa; Koichi Fukui; Yoshinori Naruta; Osamu Yamauchi
Journal of publication	Journal of the American Chemical Society
Year of publication	2007
Journal volume	129
Pages of publication	2559 - 2568
a	26.78 ± 0.01 Å
b	11.036 ± 0.005 Å
c	10.181 ± 0.005 Å
α	90°
β	90°
γ	90°
Cell volume	3009 ± 2 Å³
Cell temperature	133.2 K
Number of distinct elements	5
Space group number	60
Hermann-Mauguin space group symbol	P b c n
Hall space group symbol	-P 2n 2ab
Residual factor for significantly intense reflections	0.0423
Weighted residual factors for all reflections included in the refinement	0.1128
Goodness-of-fit parameter for all reflections included in the refinement	0.992
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4109138.cif
120076	2014-07-11	Adding DOIs to range 4/10 structures.	4109138.cif
57892	2012-05-23	cif/ Adding structures of 4109138 via cif-deposit CGI script.	4109138.cif