Crystallography Open Database

Information card for entry 4330889

Preview

Coordinates	4330889.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H70 Cl2 Ge2 N4 O Rh2 Si4
Calculated formula	C42 H70 Cl2 Ge2 N4 O Rh2 Si4
SMILES	C[Si](C)(N1[Ge]([Rh]234([CH]5=[CH]2CC[CH]3=[CH]4CC5)Cl)([N](=C1c1ccccc1)[Si](C)(C)C)O[Ge]1([N](=C(c2ccccc2)N1[Si](C)(C)C)[Si](C)(C)C)[Rh]123([CH]4=[CH]1CC[CH]2=[CH]3CC4)Cl)C
Title of publication	Bis(amidinato)germylenerhodium Complexes: Synthesis, Structure, and Density Functional Theory Calculations
Authors of publication	Dimitri Matioszek; Nathalie Saffon; Jean-Marc Sotiropoulos; Karinne Miqueu; Annie Castel; Jean Escudié
Journal of publication	Inorganic Chemistry
Year of publication	2012
Journal volume	51
Pages of publication	11716 - 11721
a	10.9112 ± 0.0004 Å
b	15.7314 ± 0.0005 Å
c	15.2579 ± 0.0006 Å
α	90°
β	92.178 ± 0.002°
γ	90°
Cell volume	2617.1 ± 0.16 Å³
Cell temperature	193 ± 2 K
Ambient diffraction temperature	193 ± 2 K
Number of distinct elements	8
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0733
Residual factor for significantly intense reflections	0.0384
Weighted residual factors for significantly intense reflections	0.0789
Weighted residual factors for all reflections included in the refinement	0.0913
Goodness-of-fit parameter for all reflections included in the refinement	1.01
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
179411 (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 4/33/08.	4330889.cif
80348	2013-04-07	cif/ Adding structures of 4330889 via cif-deposit CGI script.	4330889.cif