Crystallography Open Database

Information card for entry 4106065

Preview

Coordinates	4106065.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H30 N2 O6 Pt
Calculated formula	C24 H30 N2 O6 Pt
SMILES	[Pt]123Oc4c(cccc4)C=[N]2CCOCCOCCOCCOCC[N]3=Cc2c(cccc2)O1
Title of publication	Highly Phosphorescent Crystals of Vaulted trans-Bis(salicylaldiminato)platinum(II) Complexes
Authors of publication	Naruyoshi Komiya; Minoru Okada; Kanako Fukumoto; Daisuke Jomori; Takeshi Naota
Journal of publication	Journal of the American Chemical Society
Year of publication	2011
Journal volume	133
Pages of publication	6493 - 6496
a	25.822 ± 0.002 Å
b	10.3809 ± 0.0009 Å
c	19.6309 ± 0.0016 Å
α	90°
β	115.151 ± 0.002°
γ	90°
Cell volume	4763.3 ± 0.7 Å³
Cell temperature	113.1 K
Ambient diffraction temperature	113.1 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for significantly intense reflections	0.0423
Weighted residual factors for all reflections included in the refinement	0.088
Goodness-of-fit parameter for all reflections included in the refinement	1.102
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
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.	4106065.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4106065.cif
52855	2012-04-16	../uploads/cif-deposit/cod/cif Adding structures of 4106065 via cif-deposit CGI script.	4106065.cif