Geometry & MOs

Info

ID:	302711
PubChem CID:	124392086
Reduced:	NO2C11H13 (2)
Stoich.:	AB2C11D13 (2)
Weight, g/mol:	394.152872
ΔH_f, kcal/mol:	-126.58
Dipole, Da:	3.45
IP(EA), eV:	-8.58(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(furan-2-ylmethyl)-2-[[(2S)-2-(2-methoxyphenoxy)propanoyl]amino]benzamide

Drug info:

PubChemData

Smile

C[C@@H](C(=O)NC1=CC=CC=C1C(=O)N2CCCCC2)OC3=CC=CC=C3OC

DOS

IR

Vibrations