Crystallography Open Database

Information card for entry 4332406

Preview

Coordinates	4332406.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H36 Ge4 N4 O2 Sn4
Calculated formula	C12 H36 Ge4 N4 O2 Sn4
SMILES	C[Ge](C)(C)[N]12[Sn]3[N]4([Sn]5[N]([Ge](C)(C)C)([Sn]1[N]35[Ge](C)(C)C)[Sn]24)[Ge](C)(C)C.O.O
Title of publication	Synthesis and Characterization of Imidocubanes with Exocube GeIVand SnIVSubstituents: [M(μ3-NGeMe3)]4(M = Sn, Ge, Pb); [Sn(μ3-NSnMe3)]4
Authors of publication	Eichler, Jack F.; Just, Oliver; Rees, William S.
Journal of publication	Inorganic Chemistry
Year of publication	2006
Journal volume	45
Journal issue	17
Pages of publication	6706 - 6712
a	12.52 ± 0.004 Å
b	17.891 ± 0.005 Å
c	15.642 ± 0.005 Å
α	90°
β	107.536 ± 0.005°
γ	90°
Cell volume	3340.9 ± 1.8 Å³
Cell temperature	193 ± 2 K
Ambient diffraction temperature	193 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.1583
Residual factor for significantly intense reflections	0.0865
Weighted residual factors for significantly intense reflections	0.2208
Weighted residual factors for all reflections included in the refinement	0.2579
Goodness-of-fit parameter for all reflections included in the refinement	0.975
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
179427 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/24.	4332406.cif
98297	2014-01-29	cif/ Adding structures of 4332406 via cif-deposit CGI script.	4332406.cif