Geometry & MOs

Info

ID:	28353
PubChem CID:	827171
Reduced:	ClN2C19H23 (1)
Stoich.:	AB2C19D23 (1)
Weight, g/mol:	243.125929
ΔH_f, kcal/mol:	25.2
Dipole, Da:	1.8
IP(EA), eV:	-8.41(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-3-(5-methylfuran-2-yl)propanamide

Drug info:

PubChemData

Smile

C1CN(CCC1(CNC2=CC=CC=C2)Cl)CC3=CC=CC=C3

DOS

IR

Vibrations