Crystallography Open Database

Information card for entry 4065925

Preview

Coordinates	4065925.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10 H15 Cl Ge
Calculated formula	C10 H15 Cl Ge
SMILES	Cl[Ge]1234[c]5([c]1([c]2([c]3([c]45C)C)C)C)C
Title of publication	Parallelograms and Ladders: Polymorphic Solid-State Structures and Solution Equilibria of Cp*GeCl†
Authors of publication	Rohr, Ahleah D.; Kampf, Jeff W.; Wolfe, John P.; Banaszak Holl, Mark M.
Journal of publication	Organometallics
Year of publication	2010
Journal volume	29
Journal issue	21
Pages of publication	5004
a	16.3143 ± 0.0007 Å
b	12.0713 ± 0.0006 Å
c	11.8225 ± 0.0005 Å
α	90°
β	109.368 ± 0.001°
γ	90°
Cell volume	2196.5 ± 0.17 Å³
Cell temperature	85 ± 2 K
Ambient diffraction temperature	85 ± 2 K
Number of distinct elements	4
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	0.0213
Residual factor for significantly intense reflections	0.0197
Weighted residual factors for significantly intense reflections	0.0517
Weighted residual factors for all reflections included in the refinement	0.0526
Goodness-of-fit parameter for all reflections included in the refinement	1.098
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
178552 (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 4/06/59.	4065925.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4065925.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4065925.cif
33728	2012-02-13	../uploads/cif-deposit/cod/cif Adding structures of 4065924, 4065925 via cif-deposit CGI script.	4065925.cif