Crystallography Open Database

Information card for entry 4068493

Preview

Coordinates	4068493.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	02041zzc
Formula	C30 H21 Cl2 Ga2 N3
Calculated formula	C30 H21 Cl2 Ga2 N3
Title of publication	Synthesis and Reactivity of a Tetragallium Macrocycle
Authors of publication	Kilyanek, Stefan M.; Fang, Xiangdong; Jordan, Richard F.
Journal of publication	Organometallics
Year of publication	2009
Journal volume	28
Journal issue	1
Pages of publication	300
a	40.653 ± 0.003 Å
b	40.653 ± 0.003 Å
c	9.8092 ± 0.001 Å
α	90°
β	90°
γ	120°
Cell volume	14039 ± 2 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Residual factor for all reflections	0.038
Residual factor for significantly intense reflections	0.0305
Weighted residual factors for significantly intense reflections	0.0841
Weighted residual factors for all reflections included in the refinement	0.0881
Goodness-of-fit parameter for all reflections included in the refinement	1.07
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
178574 (current)	2016-03-21	cif/4/06/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/06/84.	4068493.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4068493.cif
39789	2012-03-07	../uploads/cif-deposit/cod/cif Adding structures of 4068493 via cif-deposit CGI script.	4068493.cif