Crystallography Open Database

Information card for entry 7113839

Preview

Coordinates	7113839.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C49 H42 Au2 F6 N4 O7 P2
Calculated formula	C49 H42 Au2 F6 N4 O7 P2
Title of publication	Ring-opening polymerization of gold macrocycles and self-assembly of a coordination polymer through hydrogen-bonding
Authors of publication	Burchell, Tara J.; Eisler, Dana J.; Jennings, Michael C.; Puddephatt, Richard J.
Journal of publication	Chemical Communications (Cambridge, United Kingdom)
Year of publication	2003
Journal issue	17
Pages of publication	2228 - 2229
a	10.55 ± 0.03 Å
b	11.73 ± 0.04 Å
c	19.52 ± 0.06 Å
α	98.94 ± 0.05°
β	90.26 ± 0.05°
γ	102.28 ± 0.05°
Cell volume	2330 ± 13 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 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	0.046
Residual factor for significantly intense reflections	0.0408
Weighted residual factors for significantly intense reflections	0.0966
Weighted residual factors for all reflections included in the refinement	0.0991
Goodness-of-fit parameter for all reflections included in the refinement	1.026
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Duplicate of	7103882
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
210584 (current)	2018-09-08	cif/7/ Updating bibliography in entries 7103881-7103883, 7113838-7113840. Marking entries 7113838-7113840 as duplicates of entries 7103881-7103883.	7113839.cif
180252	2016-03-26	cif/7/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/11/38.	7113839.cif
115304	2014-06-02	cif/ Adding structures of 7113838, 7113839, 7113840 via cif-deposit CGI script.	7113839.cif