Geometry & MOs

Info

ID:	213833
PubChem CID:	81065173
Reduced:	N2O4C15H20 (1)
Stoich.:	A2B4C15D20 (1)
Weight, g/mol:	359.03684
ΔH_f, kcal/mol:	-174.6
Dipole, Da:	5.05
IP(EA), eV:	-9.8(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(4-bromo-3,5-dimethoxybenzoyl)amino]-3-methylbutanoic acid

Drug info:

PubChemData

Smile

CC(CC(=O)O)CNC(=O)C1=CC=C(C=C1)CNC(=O)C

DOS

IR

Vibrations