Geometry & MOs

Info

ID:	269342
PubChem CID:	103617052
Reduced:	NOCl2C16H17 (1)
Stoich.:	ABC2D16E17 (1)
Weight, g/mol:	285.172879
ΔH_f, kcal/mol:	-16.62
Dipole, Da:	3.05
IP(EA), eV:	-8.92(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-methoxyphenyl)-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]ethanamine

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)CCNCC2=C(C(=CC=C2)Cl)Cl

DOS

IR

Vibrations