Crystallography Open Database

Information card for entry 4513152

Preview

Coordinates	4513152.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H26 Cu2 N10
Calculated formula	C42 H26 Cu2 N10
Title of publication	New CuI2(TCNQ‒II) and CuI2(F4TCNQ‒II) Coordination Polymers
Authors of publication	Abrahams, Brendan F.; Elliott, Robert W.; Hudson, Timothy A.; Robson, Richard; Sutton, Ashley L.
Journal of publication	Crystal Growth & Design
Year of publication	2015
Journal volume	15
Journal issue	5
Pages of publication	2437
a	19.5393 ± 0.0004 Å
b	7.3878 ± 0.0001 Å
c	23.8021 ± 0.0005 Å
α	90°
β	96.295 ± 0.002°
γ	90°
Cell volume	3415.17 ± 0.11 Å³
Cell temperature	130.01 ± 0.1 K
Ambient diffraction temperature	130.01 ± 0.1 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	0.0906
Residual factor for significantly intense reflections	0.0843
Weighted residual factors for significantly intense reflections	0.2778
Weighted residual factors for all reflections included in the refinement	0.2814
Goodness-of-fit parameter for all reflections included in the refinement	1.153
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4513152.html