Geometry & MOs

Info

ID:	294142
PubChem CID:	117427683
Reduced:	ClNO2C14H20 (1)
Stoich.:	ABC2D14E20 (1)
Weight, g/mol:	269.118257
ΔH_f, kcal/mol:	-73.33
Dipole, Da:	5.51
IP(EA), eV:	-8.51(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(5-chloro-3,4-dimethoxy-2-methylphenyl)cyclopropyl]ethanamine

Drug info:

PubChemData

Smile

CCOC1=C(C=CC(=C1C2CCCCN2)Cl)OC

DOS

IR

Vibrations