Crystallography Open Database

Information card for entry 7035785

Preview

Coordinates	7035785.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10 H10 Au Br2 N3
Calculated formula	C10 H10 Au Br2 N3
Title of publication	Weak aurophilic interactions in a series of Au(iii) double salts.
Authors of publication	Chernyshev, Alexander N.; Chernysheva, Maria V.; Hirva, Pipsa; Kukushkin, Vadim Yu; Haukka, Matti
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2015
Journal volume	44
Journal issue	32
Pages of publication	14523 - 14531
a	8.1745 ± 0.0005 Å
b	16.2911 ± 0.0014 Å
c	9.6859 ± 0.0005 Å
α	90°
β	100.567 ± 0.003°
γ	90°
Cell volume	1268.01 ± 0.15 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	I 2/c 1 1
Hall space group symbol	-I 2yc
Residual factor for all reflections	0.0284
Residual factor for significantly intense reflections	0.0265
Weighted residual factors for significantly intense reflections	0.0678
Weighted residual factors for all reflections included in the refinement	0.0691
Goodness-of-fit parameter for all reflections included in the refinement	1.062
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
153220 (current)	2015-08-08	cif/ Updating files of 7035778, 7035779, 7035780, 7035781, 7035782, 7035783, 7035784, 7035785, 7035786, 7035787, 7035788, 7035789, 7035790, 7035791, 7035792, 7035793, 7035794 Original log message: Adding full bibliography for 7035778--7035794.cif.	7035785.cif
152067	2015-07-15	cif/ Adding structures of 7035778, 7035779, 7035780, 7035781, 7035782, 7035783, 7035784, 7035785, 7035786, 7035787, 7035788, 7035789, 7035790, 7035791, 7035792, 7035793, 7035794 via cif-deposit CGI script.	7035785.cif