Crystallography Open Database

Information card for entry 7023810

Preview

Coordinates	7023810.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H60 F12 Fe N24 Sb2
Calculated formula	C30 H60 F12 Fe N24 Sb2
Title of publication	Effect of the counter-anion on the spin-transition properties of a family of Fe(ii) tetrazole complexes, [Fe(i4tz)6]X2 (X = ClO4(-), PF6(-), SbF6(-), BF4(-)).
Authors of publication	Tafili-Kryeziu, Myrvete; Weil, Matthias; Muranaka, Takahiro; Bousseksou, Azzedine; Hasegawa, Miki; Jun, Akimitsu; Linert, Wolfgang
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2013
Journal volume	42
Journal issue	44
Pages of publication	15796 - 15804
a	10.9904 ± 0.0006 Å
b	11.1561 ± 0.0006 Å
c	13.2378 ± 0.0008 Å
α	100.885 ± 0.002°
β	95.591 ± 0.002°
γ	117.396 ± 0.002°
Cell volume	1383.14 ± 0.14 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1031
Residual factor for significantly intense reflections	0.0541
Weighted residual factors for significantly intense reflections	0.1336
Weighted residual factors for all reflections included in the refinement	0.1674
Goodness-of-fit parameter for all reflections included in the refinement	1.05
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179943 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/38.	7023810.cif
90644	2013-11-18	cif/ Adding structures of 7023809, 7023810, 7023811 via cif-deposit CGI script.	7023810.cif