Crystallography Open Database

Information card for entry 7051436

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Coordinates	7051436.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H24 Cl2 F6 Fe N4 P
Calculated formula	C24 H24 Cl2 F6 Fe N4 P
SMILES	[Fe]12(Cl)(Cl)([n]3ccc(cc3c3[n]1ccc(c3)C)C)[n]1ccc(cc1c1[n]2ccc(c1)C)C.[P](F)(F)(F)(F)(F)[F-]
Journal of publication	New Journal of Chemistry
Year of publication	1999
a	17.0596 ± 0.0002 Å
b	11.1202 ± 0.0002 Å
c	28.8769 ± 0.0004 Å
α	90°
β	90°
γ	90°
Cell volume	5478.13 ± 0.14 Å³
Cell temperature	193 ± 2 K
Ambient diffraction temperature	193 ± 2 K
Number of distinct elements	7
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for significantly intense reflections	0.0687
Weighted residual factors for significantly intense reflections	0.1923
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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