Geometry & MOs

Info

ID:	212698
PubChem CID:	81061559
Reduced:	BrON2C10H15 (1)
Stoich.:	ABC2D10E15 (1)
Weight, g/mol:	260.209993
ΔH_f, kcal/mol:	-13.82
Dipole, Da:	3.03
IP(EA), eV:	-8.43(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-amino-4-[2-ethoxyethyl(methyl)amino]-2-methylpentanoate

Drug info:

PubChemData

Smile

CCOCCN(C)C1=NC=C(C=C1)Br

DOS

IR

Vibrations