Geometry & MOs

Info

ID:	63981
PubChem CID:	26759612
Reduced:	FSN2O4C21H25 (1)
Stoich.:	ABC2D4E21F25 (1)
Weight, g/mol:	357.157623
ΔH_f, kcal/mol:	-182.54
Dipole, Da:	4.24
IP(EA), eV:	-9.03(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-(2-methoxy-5-methylanilino)-1-oxopropan-2-yl] 2-(4-methoxyphenyl)acetate

Drug info:

PubChemData

Smile

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)NC(=O)CCC(=O)C2=CC=C(C=C2)F)C

DOS

IR

Vibrations