Geometry & MOs

Info

ID:	295845
PubChem CID:	117545569
Reduced:	NO3C14H19 (1)
Stoich.:	AB3C14D19 (1)
Weight, g/mol:	219.162314
ΔH_f, kcal/mol:	-83.57
Dipole, Da:	4.66
IP(EA), eV:	-8.82(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(2,5-dimethylphenyl)oxetan-3-yl]propan-1-amine

Drug info:

PubChemData

Smile

CC(CN)C1(COC1)C2=CC3=C(C=C2)OCCO3

DOS

IR

Vibrations