Crystallography Open Database

Information card for entry 7100031

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Coordinates	7100031.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C37 H39 I N4 Ni
Calculated formula	C37 H39 I N4 Ni
SMILES	I[Ni]1(C(=Nc2c(cccc2C)C)C(C(=[N]1c1c(cccc1C)C)C)=Nc1c(cccc1C)C)C#[N]c1c(cccc1C)C
Journal of publication	Chemical Communications
Year of publication	2005
a	29.374 ± 0.009 Å
b	14.767 ± 0.004 Å
c	17.319 ± 0.005 Å
α	90°
β	116.599 ± 0.0011°
γ	90°
Cell volume	6717.6 ± 3.3 Å³
Cell temperature	123.1 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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