Crystallography Open Database

Information card for entry 7234846

Preview

Coordinates	7234846.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H44 Ag2 Cl2 N8 O12
Calculated formula	C48 H44 Ag2 Cl2.024 N8 O12.096
Title of publication	Influence of counterions on the supramolecular frameworks of isoquinoline-based silver(i) complexes
Authors of publication	Parra-Muñoz, Nicole; Hidalgo, Paulina I.; Ripoll, Gerardo; Belmar, Julio; Pasán, Jorge; Jiménez, Claudio A.
Journal of publication	CrystEngComm
Year of publication	2020
Journal volume	22
Journal issue	1
Pages of publication	95 - 104
a	9.2321 ± 0.0003 Å
b	11.438 ± 0.0004 Å
c	11.853 ± 0.0004 Å
α	96.574 ± 0.003°
β	91.848 ± 0.002°
γ	104.559 ± 0.003°
Cell volume	1201.06 ± 0.07 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0267
Residual factor for significantly intense reflections	0.0244
Weighted residual factors for significantly intense reflections	0.0645
Weighted residual factors for all reflections included in the refinement	0.0665
Goodness-of-fit parameter for all reflections included in the refinement	1.027
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
257435 (current)	2020-10-06	cif/ Updating files of 7234842, 7234843, 7234844, 7234845, 7234846, 7234847, 7234848 Original log message: Adding full bibliography for 7234842--7234848.cif.	7234846.cif
247655	2020-02-04	cif/ Updating files of 7234842, 7234843, 7234844, 7234845, 7234846, 7234847, 7234848 Original log message: Adding full bibliography for 7234842--7234848.cif.	7234846.cif
220523	2019-10-30	cif/ Adding structures of 7234842, 7234843, 7234844, 7234845, 7234846, 7234847, 7234848 via cif-deposit CGI script.	7234846.cif