Crystallography Open Database

Information card for entry 7705230

Preview

Coordinates	7705230.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	DS05
Formula	C50 H53 Ag Cl2 N5 O3 P2 S0.12
Calculated formula	C51 H52 Ag Cl N4 O3 P2 S
SMILES	[Ag]([S]=C(N)N/N=C/c1cc(OC)c(OCCN2CCOCC2)cc1)([P](c1ccccc1)(c1ccccc1)c1ccccc1)(Cl)[P](c1ccccc1)(c1ccccc1)c1ccccc1
Title of publication	Silver(I) complexes of 3-methoxy-4-hydroxybenzaldehyde thiosemicarbazones and triphenylphosphine: structural, cytotoxicity, and apoptotic studies.
Authors of publication	Silva, Débora E S; Becceneri, Amanda B.; Santiago, João V B; Gomes Neto, José A; Ellena, Javier; Cominetti, Márcia R; Pereira, José C M; Hannon, Michael J.; Netto, Adelino V. G.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	45
Pages of publication	16474 - 16487
a	25.427 ± 0.0009 Å
b	12.1243 ± 0.0005 Å
c	33.2299 ± 0.001 Å
α	90°
β	100.785 ± 0.003°
γ	90°
Cell volume	10063.3 ± 0.6 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	8
Space group number	15
Hermann-Mauguin space group symbol	I 1 2/a 1
Hall space group symbol	-I 2ya
Residual factor for all reflections	0.0628
Residual factor for significantly intense reflections	0.0366
Weighted residual factors for significantly intense reflections	0.0722
Weighted residual factors for all reflections included in the refinement	0.0882
Goodness-of-fit parameter for all reflections included in the refinement	1.06
Diffraction radiation probe	x-ray
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
260771 (current)	2021-01-07	cif/ Updating files of 7705230, 7705231 Original log message: Adding full bibliography for 7705230--7705231.cif.	7705230.cif
255506	2020-08-21	cif/ Adding structures of 7705230, 7705231 via cif-deposit CGI script.	7705230.cif