Crystallography Open Database

Information card for entry 4061035

Preview

Coordinates	4061035.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C37 H51 Fe N3
Calculated formula	C37 H51 Fe N3
SMILES	[Fe]1(N(C(=CC(=[N]1c1c(cccc1C(C)C)C(C)C)C)C)c1c(C(C)C)cccc1C(C)C)N(Cc1ccccc1)C
Journal of publication	Organometallics
Year of publication	2004
a	9.3051 ± 0.0011 Å
b	10.7974 ± 0.0013 Å
c	20.63 ± 0.002 Å
α	102.007 ± 0.002°
β	94.507 ± 0.002°
γ	109.212 ± 0.002°
Cell volume	1890 ± 0.4 Å³
Cell temperature	193 ± 2 K
Ambient diffraction temperature	193 ± 2 K
Number of distinct elements	4
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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