Geometry & MOs

Info

ID:	212773
PubChem CID:	81061826
Reduced:	ON3C16H31 (1)
Stoich.:	AB3C16D31 (1)
Weight, g/mol:	252.147393
ΔH_f, kcal/mol:	-50.73
Dipole, Da:	1.54
IP(EA), eV:	-8.86(1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-amino-2-[2-ethoxyethyl(methyl)amino]benzoate

Drug info:

PubChemData

Smile

CCNC1(CCCC1CCN(C)CCOC(C)C)C#N

DOS

IR

Vibrations