Geometry & MOs

Info

ID:	154050
PubChem CID:	56313422
Reduced:	ON2S2C21H22 (1)
Stoich.:	AB2C2D21E22 (1)
Weight, g/mol:	374.180584
ΔH_f, kcal/mol:	30.46
Dipole, Da:	3.74
IP(EA), eV:	-9.02(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-difluoro-N-[4-oxo-4-(3-phenylbutylamino)butyl]benzamide

Drug info:

PubChemData

Smile

CC(CCNC(=O)C1=CC=CC=C1SCC2=CSC=N2)C3=CC=CC=C3

DOS

IR

Vibrations