Geometry & MOs

Info

ID:	263956
PubChem CID:	103409748
Reduced:	NO2C7H10 (2)
Stoich.:	AB2C7D10 (2)
Weight, g/mol:	228.183778
ΔH_f, kcal/mol:	-141.71
Dipole, Da:	3.76
IP(EA), eV:	-8.18(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[ethyl-[3-(2-methoxyethoxy)propyl]amino]-2-methylpropanenitrile

Drug info:

PubChemData

Smile

COCCOCCCN1C(=O)COC2=C1C=CC(=C2)N

DOS

IR

Vibrations