Crystallography Open Database

Information card for entry 7220385

7220384 << 7220385 >> 7220386

Preview

Coordinates	7220385.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C60 H53 Ag N O P3 S
Calculated formula	C60 H53 Ag N O P3 S
SMILES	[Ag]([P](c1ccccc1)(c1ccccc1)c1ccccc1)([P](c1ccccc1)(c1ccccc1)c1ccccc1)([P](c1ccccc1)(c1ccccc1)c1ccccc1)Sc1ccccn1.CO
Title of publication	Hemilabile silver(i) complexes containing pyridyl chalcogenolate (S, Se) ligands and their utility as molecular precursors for silver chalcogenides
Authors of publication	Kole, Goutam Kumar; Vivekananda, K. V.; Kumar, Mukesh; Ganguly, Rakesh; Dey, Sandip; Jain, Vimal K.
Journal of publication	CrystEngComm
Year of publication	2015
Journal volume	17
Journal issue	23
Pages of publication	4367
a	11.4611 ± 0.0006 Å
b	12.624 ± 0.0007 Å
c	19.6133 ± 0.0013 Å
α	85.935 ± 0.005°
β	74.285 ± 0.005°
γ	71.483 ± 0.005°
Cell volume	2589.9 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1047
Residual factor for significantly intense reflections	0.0844
Weighted residual factors for significantly intense reflections	0.2321
Weighted residual factors for all reflections included in the refinement	0.2586
Goodness-of-fit parameter for all reflections included in the refinement	1.077
Diffraction radiation wavelength	1.5418 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
138552 (current)	2015-06-07	cif/ Updating files of 7220380, 7220381, 7220382, 7220383, 7220384, 7220385 Original log message: Adding full bibliography for 7220380--7220385.cif.	7220385.cif
135843	2015-05-09	cif/ Adding structures of 7220380, 7220381, 7220382, 7220383, 7220384, 7220385 via cif-deposit CGI script.	7220385.cif