Geometry & MOs

Info

ID:	259326
PubChem CID:	103164089
Reduced:	ClO2C15H19 (1)
Stoich.:	AB2C15D19 (1)
Weight, g/mol:	293.199094
ΔH_f, kcal/mol:	-73.24
Dipole, Da:	5.04
IP(EA), eV:	-9.66(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,4-dimethoxyphenyl)-3-(3-ethoxycyclobutyl)propan-2-amine

Drug info:

PubChemData

Smile

CCOC1CC(C1)CC(=O)C(C2=CC=CC=C2)Cl

DOS

IR

Vibrations