Geometry & MOs

Info

ID:	141566
PubChem CID:	52894416
Reduced:	ClSN2F3O3C18H18 (1)
Stoich.:	ABC2D3E3F18G18 (1)
Weight, g/mol:	354.194343
ΔH_f, kcal/mol:	-248.69
Dipole, Da:	2.19
IP(EA), eV:	-9.46(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-1-[benzyl(methyl)amino]-3-methyl-1-oxobutan-2-yl]-4-methoxybenzamide

Drug info:

PubChemData

Smile

CN(CC1=CC=CC=C1)C(=O)CCNS(=O)(=O)C2=CC(=C(C=C2)Cl)C(F)(F)F

DOS

IR

Vibrations