Geometry & MOs

Info

ID:	258347
PubChem CID:	103153105
Reduced:	NO4C15H19 (1)
Stoich.:	AB4C15D19 (1)
Weight, g/mol:	294.121572
ΔH_f, kcal/mol:	-154.37
Dipole, Da:	2.96
IP(EA), eV:	-9.46(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(3-acetamidobenzoyl)amino]-3-methoxybutanoic acid

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)/C=C/C(=O)NCC(CC(=O)O)OC

DOS

IR

Vibrations