Crystallography Open Database

Information card for entry 4060599

Preview

Coordinates	4060599.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	4CN-C6H4-CH2(SO2)Co(dpgH)2Py
Formula	C53 H45 Co N6 O6 S
Calculated formula	C53 H45 Co N6 O6 S
SMILES	[Co]12(S(=O)(=O)Cc3ccc(cc3)C#N)(N(O)C(=C([N]1=O)c1ccccc1)c1ccccc1)(N(O)C(=C([N]2=O)c1ccccc1)c1ccccc1)[n]1ccccc1.c1ccccc1.c1ccccc1
Journal of publication	Organometallics
Year of publication	2006
a	13.285 ± 0.002 Å
b	13.854 ± 0.002 Å
c	14.562 ± 0.002 Å
α	93.985 ± 0.002°
β	90.19 ± 0.003°
γ	115.726 ± 0.002°
Cell volume	2407 ± 0.6 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
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

Version history

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