Crystallography Open Database

Information card for entry 1573530

Preview

Coordinates	1573530.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	<i>trans</i>-Bis(quinoline-8-amine-κ^2^<i>N</i>,<i>N</i>')bis(1,1,3,3-tetracyano-2-methoxypropenido-κ<i>N</i>)iron(II)
Formula	C34 H22 Fe N12 O2
Calculated formula	C34 H22 Fe N12 O2
Title of publication	trans-Bis(quinoline-8-amine-κ2 N,N′)bis(1,1,3,3-tetracyano-2-methoxypropenido-κN)iron(II)
Authors of publication	Setifi, Fatima; Setifi, Zouaoui; Böhme, Uwe; Al-Douh, Mohammad Hadi; Satour, Achouak
Journal of publication	IUCrData
Year of publication	2024
Journal volume	9
Journal issue	12
a	8.3617 ± 0.0005 Å
b	9.8067 ± 0.0006 Å
c	10.1251 ± 0.0005 Å
α	100.206 ± 0.003°
β	90.276 ± 0.003°
γ	90.5 ± 0.003°
Cell volume	817.08 ± 0.08 Å³
Cell temperature	299 ± 2 K
Ambient diffraction temperature	299 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0495
Residual factor for significantly intense reflections	0.0385
Weighted residual factors for significantly intense reflections	0.0955
Weighted residual factors for all reflections included in the refinement	0.1037
Goodness-of-fit parameter for all reflections included in the refinement	1.058
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
296960 (current)	2024-12-24	cif/ Adding structures of 1573530 via cif-deposit CGI script.	1573530.cif