Geometry & MOs

Info

ID:	61994
PubChem CID:	26716738
Reduced:	SN2O5C20H24 (1)
Stoich.:	AB2C5D20E24 (1)
Weight, g/mol:	478.156243
ΔH_f, kcal/mol:	-187.14
Dipole, Da:	4.2
IP(EA), eV:	-9.34(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(2-methoxybenzoyl)amino]phenyl] (2R)-2-benzamido-4-methylsulfanylbutanoate

Drug info:

PubChemData

Smile

CCNS(=O)(=O)C1=CC(=C(C=C1)C)C(=O)NC2=CC=C(C=C2)C(=O)OC(C)C

DOS

IR

Vibrations