Geometry & MOs

Info

ID:	295309
PubChem CID:	117525993
Reduced:	FSN2H11C13 (1)
Stoich.:	ABC2D11E13 (1)
Weight, g/mol:	255.137162
ΔH_f, kcal/mol:	21.44
Dipole, Da:	2.4
IP(EA), eV:	-9.74(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(furan-2-yl)-3H-benzimidazol-5-yl]butan-2-amine

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)CCC2=CC=C(C=C2)F)C#N

DOS

IR

Vibrations