Crystallography Open Database

Information card for entry 1542773

Preview

Coordinates	1542773.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C61 H40 Ag4 F28 N4 O8
Calculated formula	C61 H40 Ag4 F28 N4 O8
Title of publication	Solvent-vapour-assisted pathways and the role of pre-organization in solid-state transformations of coordination polymers
Authors of publication	Wright, James S.; Vitórica-Yrezábal, Iñigo J.; Adams, Harry; Thompson, Stephen P.; Hill, Adrian H.; Brammer, Lee
Journal of publication	IUCrJ
Year of publication	2015
Journal volume	2
Journal issue	2
Pages of publication	188 - 197
a	10.6531 ± 0.0007 Å
b	11.2628 ± 0.0007 Å
c	14.4311 ± 0.001 Å
α	72.401 ± 0.003°
β	86.598 ± 0.003°
γ	82.882 ± 0.003°
Cell volume	1637.3 ± 0.19 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 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	0.0753
Residual factor for significantly intense reflections	0.0649
Weighted residual factors for significantly intense reflections	0.1612
Weighted residual factors for all reflections included in the refinement	0.1673
Goodness-of-fit parameter for all reflections included in the refinement	1.086
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
178177 (current)	2016-03-13	cif/ Adding structures of 1542773, 1542774, 1542775, 1542776, 1542777, 1542778 via cif-deposit CGI script.	1542773.cif