Crystallography Open Database

Information card for entry 7100217

Preview

Coordinates	7100217.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C46 H58 Cl2 Fe2 N8 O17
Calculated formula	C46 H58 Cl2 Fe2 N8 O17
Title of publication	Ortho-hydroxylation of benzoic acids with hydrogen peroxide at a non-heme iron center
Authors of publication	Elena Rybak-Akimova; Bruce M. Foxman; L.Que Junior; Sonia Taktak
Journal of publication	Chemical Communications
Year of publication	2005
a	15.874 ± 0.005 Å
b	11.407 ± 0.004 Å
c	29.333 ± 0.01 Å
α	90°
β	101.599 ± 0.007°
γ	90°
Cell volume	5203 ± 3 Å³
Cell temperature	193 ± 2 K
Ambient diffraction temperature	193 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

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