Crystallography Open Database

Information card for entry 7101007

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Coordinates	7101007.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C43 H59 Cl N Nb O3
Calculated formula	C43 H59 Cl N Nb O3
SMILES	[Nb]1(Cl)(Oc2c(cccc2C(C)C)C(C)C)(Oc2c(cccc2C(C)C)C(C)C)(Oc2c(cccc2C(C)C)C(C)C)[n]2c(cccc2)C1C
Journal of publication	Chemical Communications
Year of publication	2005
a	16.465 ± 0.001 Å
b	13.6886 ± 0.0007 Å
c	18.7548 ± 0.0009 Å
α	90°
β	107.699 ± 0.003°
γ	90°
Cell volume	4026.9 ± 0.4 Å³
Cell temperature	150 K
Ambient diffraction temperature	150 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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