Geometry & MOs

Info

ID:	55583
PubChem CID:	17395595
Reduced:	OS2N5C21H25 (1)
Stoich.:	AB2C5D21E25 (1)
Weight, g/mol:	247.100857
ΔH_f, kcal/mol:	47.52
Dipole, Da:	5.34
IP(EA), eV:	-8.41(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-fluorophenyl)methyl]-3-(furan-2-yl)propanamide

Drug info:

PubChemData

Smile

CN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)CN3CCCC3)CC4=CC=CS4

DOS

IR

Vibrations