Crystallography Open Database

Information card for entry 7033919

Preview

Coordinates	7033919.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C41 H51 Ga N2 Te2
Calculated formula	C41 H51 Ga N2 Te2
SMILES	[Ga]1([Te]c2ccccc2)([Te]c2ccccc2)N(C(=CC(=[N]1c1c(cccc1C(C)C)C(C)C)C)C)c1c(cccc1C(C)C)C(C)C
Title of publication	Te-Te and Te-C bond cleavage reactions using a monovalent gallanediyl.
Authors of publication	Ganesamoorthy, Chelladurai; Bendt, Georg; Bläser, Dieter; Wölper, Christoph; Schulz, Stephan
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2015
Journal volume	44
Journal issue	11
Pages of publication	5153 - 5159
a	19.1512 ± 0.0008 Å
b	19.707 ± 0.0008 Å
c	20.3343 ± 0.0008 Å
α	90°
β	90°
γ	90°
Cell volume	7674.4 ± 0.5 Å³
Cell temperature	100 ± 1 K
Ambient diffraction temperature	100 ± 1 K
Number of distinct elements	5
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.087
Residual factor for significantly intense reflections	0.0469
Weighted residual factors for significantly intense reflections	0.0941
Weighted residual factors for all reflections included in the refinement	0.1249
Goodness-of-fit parameter for all reflections included in the refinement	1.127
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
180045 (current)	2016-03-25	cif/7/03/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/03/39.	7033919.cif
133396	2015-03-06	cif/ Updating files of 7033918, 7033919, 7033920, 7033921 Original log message: Adding full bibliography for 7033918--7033921.cif.	7033919.cif
131222	2015-02-06	cif/ Adding structures of 7033918, 7033919, 7033920, 7033921 via cif-deposit CGI script.	7033919.cif