Crystallography Open Database

Information card for entry 4114488

Preview

Coordinates	4114488.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	UWFIV224-compound 8b
Formula	C35 H54 N2 Pt
Calculated formula	C35 H54 N2 Pt
SMILES	[PtH]12(N(C(=CC(=[N]1c1c(cc(cc1C)C(C)(C)C)C)C)C)c1c(cc(cc1C)C(C)(C)C)C)[CH2]=[CH]2C(C)(C)C
Title of publication	β-Diiminate Platinum Complexes for Alkane Dehydrogenation
Authors of publication	Ulrich Fekl; Werner Kaminsky; Karen I. Goldberg
Journal of publication	Journal of the American Chemical Society
Year of publication	2003
Journal volume	125
Pages of publication	15286 - 15287
a	9.622 ± 0.0008 Å
b	9.968 ± 0.0011 Å
c	18.557 ± 0.003 Å
α	81.019 ± 0.008°
β	81.772 ± 0.008°
γ	69.642 ± 0.006°
Cell volume	1640.6 ± 0.4 Å³
Cell temperature	130 ± 2 K
Ambient diffraction temperature	130 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0731
Residual factor for significantly intense reflections	0.0597
Weighted residual factors for significantly intense reflections	0.1335
Weighted residual factors for all reflections included in the refinement	0.1415
Goodness-of-fit parameter for significantly intense reflections	1.01
Goodness-of-fit parameter for all reflections included in the refinement	1.01
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
178915 (current)	2016-03-22	cif/4/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/11/44.	4114488.cif
120077	2014-07-12	Adding DOIs to range 4/11 structures.	4114488.cif
67815	2012-10-05	cif/ Adding structures of 4114488 via cif-deposit CGI script.	4114488.cif