Geometry & MOs

Info

ID:	36307
PubChem CID:	8001530
Reduced:	FOSN3H18C21 (1)
Stoich.:	ABCD3E18F21 (1)
Weight, g/mol:	245.141579
ΔH_f, kcal/mol:	12.25
Dipole, Da:	4.37
IP(EA), eV:	-8.66(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-methyl-1-benzofuran-3-yl)-N-(2-methylpropyl)acetamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CCNC2=C3C(=CSC3=NC=N2)C4=CC=C(C=C4)F

DOS

IR

Vibrations