Geometry & MOs

Info

ID:	61783
PubChem CID:	26713060
Reduced:	SCl2N2O3H14C15 (1)
Stoich.:	AB2C2D3E14F15 (1)
Weight, g/mol:	438.134635
ΔH_f, kcal/mol:	-90.68
Dipole, Da:	1.25
IP(EA), eV:	-9.56(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R)-1-(4-chlorophenyl)ethyl]-4-[2-(3-methoxyanilino)-2-oxoethoxy]benzamide

Drug info:

PubChemData

Smile

C[C@@H](C1=CC=C(C=C1)Cl)NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N

DOS

IR

Vibrations