Geometry & MOs

Info

ID:	258253
PubChem CID:	103152281
Reduced:	NOC7H12 (2)
Stoich.:	ABC7D12 (2)
Weight, g/mol:	226.168128
ΔH_f, kcal/mol:	-67.25
Dipole, Da:	4.32
IP(EA), eV:	-8.7(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-ethyl-N'-(furan-2-ylmethyl)-2-methoxybutane-1,4-diamine

Drug info:

PubChemData

Smile

CN(CCC(CN)OC)CC1=CC=CC=C1OC

DOS

IR

Vibrations