Geometry & MOs

Info

ID:	4286
PubChem CID:	11114
Reduced:	ClN2O2C13H21 (1)
Stoich.:	AB2C2D13E21 (1)
Weight, g/mol:	272.129156
ΔH_f, kcal/mol:	-118.09
Dipole, Da:	3.05
IP(EA), eV:	-8.86(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methylpropylamino)ethyl 3-aminobenzoate;hydrochloride

Drug info:

PubChemData

Smile

CC(C)CNCCOC(=O)C1=CC(=CC=C1)N.Cl

DOS

IR

Vibrations