Crystallography Open Database

Information card for entry 4067614

Preview

Coordinates	4067614.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C31 H35 N3 Pt
Calculated formula	C31 H35 N3 Pt
SMILES	[Pt]12(c3ccccc3N(c3c2cccc3)C)[n]2ccc(cc2c2[n]1ccc(c2)C(C)(C)C)C(C)(C)C
Title of publication	Syntheses, Structures, and Reductive Elimination Studies of Six-Membered Diaryl Platinacycle Complexes
Authors of publication	Robinson, Robert; Sharp, Paul R.
Journal of publication	Organometallics
Year of publication	2010
Journal volume	29
Journal issue	6
Pages of publication	1388
a	15.135 ± 0.003 Å
b	11.747 ± 0.002 Å
c	16.225 ± 0.003 Å
α	90°
β	113.103 ± 0.003°
γ	90°
Cell volume	2653.3 ± 0.9 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0325
Residual factor for significantly intense reflections	0.0256
Weighted residual factors for significantly intense reflections	0.0617
Weighted residual factors for all reflections included in the refinement	0.0662
Goodness-of-fit parameter for all reflections included in the refinement	1.025
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
178567 (current)	2016-03-21	cif/4/06/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/06/76.	4067614.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4067614.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4067614.cif
34245	2012-02-13	../uploads/cif-deposit/cod/cif Adding structures of 4067612, 4067613, 4067614 via cif-deposit CGI script.	4067614.cif