Geometry & MOs

Info

ID:	431118
PubChem CID:	135171188
Reduced:	NC10H22 (2)
Stoich.:	AB10C22 (2)
Weight, g/mol:	441.216475
ΔH_f, kcal/mol:	-83.47
Dipole, Da:	3.07
IP(EA), eV:	-8.87(2.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[(3-cyano-1-benzofuran-2-yl)methylamino]cyclohexyl]-N-ethyl-1H-benzimidazole-2-carboxamide

Drug info:

PubChemData

Smile

CCCCCCCCCCCC(C)CNCCCNCCC

DOS

IR

Vibrations