Crystallography Open Database

Information card for entry 7233450

Preview

Coordinates	7233450.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H38 Ag P3 S
Calculated formula	C48 H38 Ag P3 S
SMILES	[Ag]12(Sc3c([P]2(c2ccccc2)c2ccccc2)cccc3)[P](c2ccccc2)(c2ccccc2)c2ccccc2[P]1(c1ccccc1)c1ccccc1
Title of publication	Application of neutral d10 coinage metal complexes with an anionic bidentate ligand in delayed fluorescence-type organic light-emitting diodes
Authors of publication	Masahisa Osawa; Isao Kawata; Ryuji Ishii; Satoshi Igawa; Masashi Hashimoto; Mikio Hoshino
Journal of publication	Journal of Materials Chemistry C
Year of publication	2013
Journal volume	1
Pages of publication	4375 - 4383
a	10.8301 ± 0.0006 Å
b	12.0774 ± 0.0006 Å
c	15.888 ± 0.0009 Å
α	72.281 ± 0.002°
β	88.762 ± 0.002°
γ	81.29 ± 0.002°
Cell volume	1956.06 ± 0.18 Å³
Cell temperature	110 K
Ambient diffraction temperature	110 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.073
Residual factor for significantly intense reflections	0.0433
Weighted residual factors for significantly intense reflections	0.1031
Weighted residual factors for all reflections included in the refinement	0.1305
Goodness-of-fit parameter for all reflections included in the refinement	1.05
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
217720 (current)	2019-08-26	cif/ Adding structures of 7233450 via cif-deposit CGI script.	7233450.cif