Crystallography Open Database

Information card for entry 7032014

7032013 << 7032014 >> 7032015

Preview

Coordinates	7032014.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C6 H15 Sb Se
Calculated formula	C6 H15 Sb Se
Title of publication	The bonding situation in triethylchalcogenostiboranes - polarized single bonds vs. double bonds.
Authors of publication	Heimann, Stefan; Bläser, Dieter; Wölper, Christoph; Haack, Rebekka; Jansen, Georg; Schulz, Stephan
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2014
Journal volume	43
Journal issue	39
Pages of publication	14772 - 14777
a	9.2201 ± 0.0011 Å
b	9.2201 ± 0.0011 Å
c	6.5289 ± 0.0008 Å
α	90°
β	90°
γ	120°
Cell volume	480.66 ± 0.1 Å³
Cell temperature	100 ± 1 K
Ambient diffraction temperature	100 ± 1 K
Number of distinct elements	4
Space group number	186
Hermann-Mauguin space group symbol	P 63 m c
Hall space group symbol	P 6c -2c
Residual factor for all reflections	0.0197
Residual factor for significantly intense reflections	0.0195
Weighted residual factors for significantly intense reflections	0.0494
Weighted residual factors for all reflections included in the refinement	0.0495
Goodness-of-fit parameter for all reflections included in the refinement	1.228
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
180026 (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 7/03/20.	7032014.cif
124758	2014-10-06	cif/ Updating files of 7032014, 7032015, 7032016 Original log message: Adding full bibliography for 7032014--7032016.cif.	7032014.cif
121925	2014-08-14	cif/ Adding structures of 7032014, 7032015, 7032016 via cif-deposit CGI script.	7032014.cif