Geometry & MOs

Info

ID:	302707
PubChem CID:	124392069
Reduced:	SN2O4C24H24 (1)
Stoich.:	AB2C4D24E24 (1)
Weight, g/mol:	418.189257
ΔH_f, kcal/mol:	-84.52
Dipole, Da:	6.86
IP(EA), eV:	-8.66(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(2S)-2-(2-methoxyphenoxy)propanoyl]amino]-N-[(1S)-1-phenylethyl]benzamide

Drug info:

PubChemData

Smile

C1C[C@@H](CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4

DOS

IR

Vibrations