Crystallography Open Database

Information card for entry 7702449

Preview

Coordinates	7702449.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	[agdbp]PO2F2
Chemical name	[1,4-Bis(4'-pyridyl)butadiynesilver(I)] bis(difluorodioxophosphate) acetonitrile solvate
Formula	C16 H11 Ag F2 N3 O2 P
Calculated formula	C16 H11 Ag F2 N3 O2 P
Title of publication	Long-range chain orientation in 1-D co-ordination polymers as a function of anions and intermolecular aromatic interactions
Authors of publication	Blake, Alexander J.; Baum, Gerhard; Champness, Neil R.; Chung, Simon S. M.; Cooke, Paul A.; Fenske, Dieter; Khlobystov, Andrei N.; Lemenovskii, Dmitrii A.; Li, Wan-Sheung; Schröder, Martin
Journal of publication	Journal of the Chemical Society, Dalton Transactions
Year of publication	2000
Journal issue	23
Pages of publication	4285
a	7.493 ± 0.0015 Å
b	8.285 ± 0.0017 Å
c	14.723 ± 0.003 Å
α	101.91 ± 0.03°
β	90.11 ± 0.03°
γ	107.69 ± 0.03°
Cell volume	850 ± 0.4 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	0.0372
Residual factor for significantly intense reflections	0.0308
Weighted residual factors for significantly intense reflections	0.0718
Weighted residual factors for all reflections included in the refinement	0.077
Goodness-of-fit parameter for all reflections included in the refinement	1.142
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
243870 (current)	2019-11-28	cif/ Adding structures of 7702444, 7702445, 7702446, 7702447, 7702448, 7702449, 7702450, 7702451 via cif-deposit CGI script.	7702449.cif