Crystallography Open Database

Information card for entry 4337473

Preview

Coordinates	4337473.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C34 H52 Cl2 Cu4 Ge2 I4 N6
Calculated formula	C34 H52 Cl2 Cu4 Ge2 I4 N6
SMILES	[I]12[Cu]3456([N]#CC)[I]7[Cu]8914([I]1[Cu]4258([I]3[Cu]67914[N]#CC)[Ge]1([N](=C2C=CC=CC=C2N1CC(C)C)CC(C)C)Cl)[Ge]1([N](=C2C=CC=CC=C2N1CC(C)C)CC(C)C)Cl
Title of publication	Aminotroponiminato(chloro)germylene stabilized copper(I) iodide complexes: synthesis and structure.
Authors of publication	Yadav, Dhirendra; Siwatch, Rahul Kumar; Sinhababu, Soumen; Nagendran, Selvarajan
Journal of publication	Inorganic chemistry
Year of publication	2014
Journal volume	53
Journal issue	1
Pages of publication	600 - 606
a	11.2556 ± 0.0008 Å
b	11.2128 ± 0.0008 Å
c	19.2242 ± 0.0014 Å
α	90°
β	93.579 ± 0.001°
γ	90°
Cell volume	2421.5 ± 0.3 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	7
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/c 1
Hall space group symbol	-P 2yc
Residual factor for all reflections	0.0368
Residual factor for significantly intense reflections	0.0284
Weighted residual factors for significantly intense reflections	0.0686
Weighted residual factors for all reflections included in the refinement	0.0717
Goodness-of-fit parameter for all reflections included in the refinement	1.044
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
179477 (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 4/33/74.	4337473.cif
106398	2014-03-15	cif/ Adding structures of 4337473, 4337474, 4337475 via cif-deposit CGI script.	4337473.cif