Crystallography Open Database

Information card for entry 4339347

Preview

Coordinates	4339347.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C89 H84 Fe2 N14 O8 P2
Calculated formula	C89 H62 Fe2 N14 O8 P2
Title of publication	Field-induced metamagnetic transition in the Fe(III)-Mn(III) bimetallic chain built by a new cyanide-bearing Fe(III) precursor.
Authors of publication	Kim, Jae Il; Yoo, Houng Sik; Koh, Eui Kwan; Hong, Chang Seop
Journal of publication	Inorganic chemistry
Year of publication	2007
Journal volume	46
Journal issue	25
Pages of publication	10461 - 10463
a	37.6511 ± 0.001 Å
b	9.2841 ± 0.0003 Å
c	27.9437 ± 0.0009 Å
α	90°
β	122.201 ± 0.002°
γ	90°
Cell volume	8265.4 ± 0.5 Å³
Cell temperature	130 ± 2 K
Ambient diffraction temperature	130 ± 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	0.1345
Residual factor for significantly intense reflections	0.0656
Weighted residual factors for significantly intense reflections	0.1483
Weighted residual factors for all reflections included in the refinement	0.1801
Goodness-of-fit parameter for all reflections included in the refinement	1.024
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
179496 (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 4/33/93.	4339347.cif
117277	2014-06-14	cif/ Adding structures of 4339347 via cif-deposit CGI script.	4339347.cif