Geometry & MOs

Info

ID:	252211
PubChem CID:	103109810
Reduced:	NOC8H9 (2)
Stoich.:	ABC8D9 (2)
Weight, g/mol:	224.188863
ΔH_f, kcal/mol:	-60.11
Dipole, Da:	7.06
IP(EA), eV:	-8.32(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-[(2,5-dimethylfuran-3-yl)methyl]-1-N-ethyl-1-N-methylpropane-1,2-diamine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C(=O)NCC2=C(C(=CC=C2)N)C)O

DOS

IR

Vibrations