Geometry & MOs

Info

ID:	212652
PubChem CID:	81061337
Reduced:	N4C15H22 (1)
Stoich.:	A4B15C22 (1)
Weight, g/mol:	266.163043
ΔH_f, kcal/mol:	26.26
Dipole, Da:	5.23
IP(EA), eV:	-8.9(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-amino-4-[2-ethoxyethyl(methyl)amino]benzoate

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=N1)C)C#N)NC(C)CN2CCCC2

DOS

IR

Vibrations