Geometry & MOs

Info

ID:	295843
PubChem CID:	117545552
Reduced:	NOC13H19 (1)
Stoich.:	ABC13D19 (1)
Weight, g/mol:	219.162314
ΔH_f, kcal/mol:	-20.71
Dipole, Da:	2.22
IP(EA), eV:	-9.37(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(4-ethylphenyl)oxetan-3-yl]propan-1-amine

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C2(COC2)C(C)CN

DOS

IR

Vibrations