Crystallography Open Database

Information card for entry 1574002

Preview

Coordinates	1574002.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C39 H45 Ag6 F9 N3 O6 S3
Calculated formula	C39 H45 Ag6 F9 N3 O6 S3
Title of publication	Linker driven site-specific catalysis in atomically precise silver cluster assemblies.
Authors of publication	Chandrashekar, Priyanka; Karmakar, Arun; Aparna, Ravari Kandy; Singh, Laddi; Mondal, Pradip Kumar; Kundu, Subrata; Bhattacharyya, Kalishankar; Mandal, Sukhendu
Journal of publication	Chemical science
Year of publication	2025
Journal volume	16
Journal issue	13
Pages of publication	5726 - 5734
a	22.946 ± 0.005 Å
b	27.85 ± 0.006 Å
c	18.982 ± 0.004 Å
α	90°
β	90°
γ	90°
Cell volume	12130 ± 5 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	7
Space group number	58
Hermann-Mauguin space group symbol	P n n m
Hall space group symbol	-P 2 2n
Residual factor for all reflections	0.0993
Residual factor for significantly intense reflections	0.0848
Weighted residual factors for significantly intense reflections	0.2608
Weighted residual factors for all reflections included in the refinement	0.2755
Goodness-of-fit parameter for all reflections included in the refinement	1.112
Diffraction radiation wavelength	0.7 Å
Diffraction radiation type	Synchrotron
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
298800 (current)	2025-04-05	cif/ Updating files of 1573999, 1574000, 1574001, 1574002 Original log message: Adding full bibliography for 1573999--1574002.cif.	1574002.cif
297887	2025-02-27	cif/ Adding structures of 1573999, 1574000, 1574001, 1574002 via cif-deposit CGI script.	1574002.cif