Geometry & MOs

Info

ID:	295854
PubChem CID:	117545855
Reduced:	ClNO2C14H20 (1)
Stoich.:	ABC2D14E20 (1)
Weight, g/mol:	249.172879
ΔH_f, kcal/mol:	-60.09
Dipole, Da:	2.89
IP(EA), eV:	-8.94(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(4-methoxy-3-methylphenyl)oxetan-3-yl]-N-methylpropan-1-amine

Drug info:

PubChemData

Smile

CNCCCC1(COC1)C2=CC(=C(C=C2)OC)Cl

DOS

IR

Vibrations