Crystallography Open Database

Information card for entry 1512479

Preview

Coordinates	1512479.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H50 Cl2 N6 Ni O10
Calculated formula	C24 H50 Cl2 N6 Ni O10
Title of publication	Synthesis and hydrolysis of cis-octahedral nickel(II) complexes with C-racemic tetraaza macrocycles bearing two imidate ester pendant arms
Authors of publication	Soonmoo Bang; Nahee Kim; Shin-Geol Kang; Jong Hwa Jeong
Journal of publication	Inorganica Chimica Acta
Year of publication	2012
Journal volume	392
Pages of publication	184 - 191
a	36.748 ± 0.003 Å
b	20.6365 ± 0.0009 Å
c	19.503 ± 0.003 Å
α	90°
β	119.74 ± 0.08°
γ	90°
Cell volume	12842 ± 11 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
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	0.1449
Residual factor for significantly intense reflections	0.0551
Weighted residual factors for significantly intense reflections	0.1445
Weighted residual factors for all reflections included in the refinement	0.161
Goodness-of-fit parameter for all reflections included in the refinement	0.917
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
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/1512479.html