Crystallography Open Database

Information card for entry 4337475

Preview

Coordinates	4337475.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H56 Cl2 Cu2 Ge2 I2 N6
Calculated formula	C40 H56 Cl2 Cu2 Ge2 I2 N6
SMILES	C12=CC=CC=CC1=[N](CC(C)C)[Ge](N2CC(C)C)(Cl)[Cu]1([I][Cu]([I]1)([n]1ccccc1)[Ge]1([N](=C2C=CC=CC=C2N1CC(C)C)CC(C)C)Cl)[n]1ccccc1
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	9.8792 ± 0.001 Å
b	12.7926 ± 0.0012 Å
c	19.0572 ± 0.0018 Å
α	90°
β	90.856 ± 0.002°
γ	90°
Cell volume	2408.2 ± 0.4 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	7
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	0.0631
Residual factor for significantly intense reflections	0.0437
Weighted residual factors for significantly intense reflections	0.1115
Weighted residual factors for all reflections included in the refinement	0.1206
Goodness-of-fit parameter for all reflections included in the refinement	1.026
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.	4337475.cif
106398	2014-03-15	cif/ Adding structures of 4337473, 4337474, 4337475 via cif-deposit CGI script.	4337475.cif