Crystallography Open Database

Information card for entry 7100336

Preview

Coordinates	7100336.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C49 H86 Fe9 K5 N8 O54
Calculated formula	C49 H56 Fe9 K5 N8 O54
Title of publication	Encapsulation of [Fe(H2O)6]3+ by dinuclear {Fe2(hpdta)} units leads to a nonanuclear S = 13/2 Fe(III) oxo cluster showing magnetic hysteresis
Authors of publication	Wolfgang Schmitt; Christopher E. Anson; Wolfgang Wernsdorfer; Annie K. Powell
Journal of publication	Chemical Communications
Year of publication	2005
a	12.9507 ± 0.0015 Å
b	13.7625 ± 0.0017 Å
c	13.7737 ± 0.0016 Å
α	105.88 ± 0.009°
β	113.106 ± 0.009°
γ	102.777 ± 0.009°
Cell volume	2016.5 ± 0.4 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
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7100336.html