Crystallography Open Database

Information card for entry 4065819

Preview

Coordinates	4065819.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C13 H22 Cl2 N Rh
Calculated formula	C13 H22 Cl2 N Rh
SMILES	[Rh]12345(Cl)(Cl)[N](C)(C)CC[c]61[c]2([c]3([c]4([c]56C)C)C)C
Title of publication	Synthesis and Structure of Protic Amine Tethered Rhodium(III) Peralkylcyclopentadienyl Complexes
Authors of publication	Ito, Masato; Tejima, Noriko; Yamamura, Masahiro; Endo, Yoshinori; Ikariya, Takao
Journal of publication	Organometallics
Year of publication	2010
Journal volume	29
Journal issue	8
Pages of publication	1886
a	16.2809 ± 0.0011 Å
b	14.3063 ± 0.0013 Å
c	25.6018 ± 0.0019 Å
α	90°
β	90°
γ	90°
Cell volume	5963.2 ± 0.8 Å³
Cell temperature	193.1 K
Ambient diffraction temperature	193 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 significantly intense reflections	0.0273
Weighted residual factors for all reflections included in the refinement	0.1504
Goodness-of-fit parameter for all reflections included in the refinement	1
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4065819.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4065819.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4065819.cif
33699	2012-02-13	../uploads/cif-deposit/cod/cif Adding structures of 4065819, 4065820, 4065821, 4065822, 4065823, 4065824 via cif-deposit CGI script.	4065819.cif