Geometry & MOs

Info

ID:	203166
PubChem CID:	79789517
Reduced:	NO4C16H23 (1)
Stoich.:	AB4C16D23 (1)
Weight, g/mol:	292.142307
ΔH_f, kcal/mol:	-178.07
Dipole, Da:	3.9
IP(EA), eV:	-9.25(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-2-[[2-[(3-methylbenzoyl)amino]acetyl]amino]butanoic acid

Drug info:

PubChemData

Smile

CCCCOC1=CC=C(C=C1)C(=O)NC(C)(CC)C(=O)O

DOS

IR

Vibrations