Crystallography Open Database

Information card for entry 7100224

Preview

Coordinates	7100224.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C19 H33 Fe N12 O7
Calculated formula	C19 H33 Fe N12 O7
SMILES	c12[n](c(nc(n1)N1CCOCC1)N(C)O)[Fe]13([n]4c(nc(nc4N(C)O3)N3CCOCC3)N(C)O1)ON2C.CO
Title of publication	Bis-hydroxyaminotriazines: highly stable hydroxylamine-based ligands for iron(III) cations
Authors of publication	Artem Melman; Irina Ekeltchik; Jenny Gun; Ovadia Lev
Journal of publication	Chemical Communications
Year of publication	2005
a	11.4324 ± 0.0009 Å
b	13.9381 ± 0.0011 Å
c	17.358 ± 0.0014 Å
α	92.236 ± 0.001°
β	101.447 ± 0.001°
γ	92.208 ± 0.001°
Cell volume	2705.8 ± 0.4 Å³
Cell temperature	295 ± 1 K
Ambient diffraction temperature	295 ± 1 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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